USER MOD reduce.3.24.130724 H: found=0, std=0, add=1136, rem=0, adj=25 USER MOD reduce.3.24.130724 removed 1136 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: B 51 TYR OH : rot 75:sc= 0.309 USER MOD Set 1.2: B 55 GLN : amide:sc=-0.000463 X(o=0.31,f=0.31) USER MOD Set 2.1: A 21 GLN : amide:sc= -0.575 X(o=-0.6,f=-0.31) USER MOD Set 2.2: A 35 TYR OH : rot 180:sc= -0.0262 USER MOD Single : A 1 MET CE :methyl -160:sc= -0.152 (180deg=-0.612) USER MOD Single : A 1 MET N :NH3+ -178:sc= 0 (180deg=-0.0055) USER MOD Single : A 4 ASN : amide:sc= 0 X(o=0,f=-0.0095) USER MOD Single : A 6 MET CE :methyl -159:sc= -0.158 (180deg=-0.712) USER MOD Single : A 9 ASN : amide:sc= 0.0239 X(o=0.024,f=0) USER MOD Single : A 10 ASN : amide:sc= -0.0729 K(o=-0.073,f=-1.9) USER MOD Single : A 12 HIS : no HD1:sc= -0.0897 K(o=-0.09,f=-0.59) USER MOD Single : A 14 LYS NZ :NH3+ -173:sc= 1.03 (180deg=0.885) USER MOD Single : A 16 THR OG1 : rot 34:sc= 0.474 USER MOD Single : A 18 THR OG1 : rot 180:sc= 0 USER MOD Single : A 25 TYR OH : rot 180:sc= 0 USER MOD Single : A 30 THR OG1 : rot -51:sc= 0.709 USER MOD Single : A 47 ASN : amide:sc= 0.0116 K(o=0.012,f=-0.73) USER MOD Single : A 51 TYR OH : rot 180:sc= 0 USER MOD Single : A 55 GLN : amide:sc= 1.11 K(o=1.1,f=-0.25) USER MOD Single : A 61 LYS NZ :NH3+ -155:sc= 0.137 (180deg=-0.523) USER MOD Single : A 62 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 64 GLN :FLIP amide:sc= -0.0123 F(o=-0.94,f=-0.012) USER MOD Single : A 67 HIS : no HD1:sc= -0.136 X(o=-0.14,f=0) USER MOD Single : A 68 HIS : no HE2:sc= 0.755 K(o=0.75,f=-5.9!) USER MOD Single : A 69 HIS : no HD1:sc= 0 X(o=0,f=-0.014) USER MOD Single : A 70 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 71 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 72 HIS : no HD1:sc= 0 X(o=0,f=-0.0083) USER MOD Single : B 1 MET CE :methyl -161:sc= -0.058 (180deg=-0.425) USER MOD Single : B 1 MET N :NH3+ -140:sc= 1.41 (180deg=-0.155) USER MOD Single : B 4 ASN :FLIP amide:sc=-0.00324 F(o=-1.9,f=-0.0032) USER MOD Single : B 6 MET CE :methyl 145:sc= -0.141 (180deg=-1) USER MOD Single : B 9 ASN : amide:sc= 0 K(o=0,f=-0.51) USER MOD Single : B 10 ASN : amide:sc= 0.112 K(o=0.11,f=-3.6!) USER MOD Single : B 12 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : B 14 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 16 THR OG1 : rot -2:sc= 0.993 USER MOD Single : B 18 THR OG1 : rot -27:sc= 0.455 USER MOD Single : B 21 GLN :FLIP amide:sc= -0.338 F(o=-1.6!,f=-0.34) USER MOD Single : B 25 TYR OH : rot 180:sc= 0 USER MOD Single : B 30 THR OG1 : rot -66:sc= -0.0463 USER MOD Single : B 35 TYR OH : rot 180:sc= -0.994 USER MOD Single : B 47 ASN : amide:sc= -0.102 K(o=-0.1,f=-1) USER MOD Single : B 61 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 62 ASN : amide:sc= 0.903 K(o=0.9,f=-3.8!) USER MOD Single : B 64 GLN :FLIP amide:sc= -0.149 F(o=-1.2,f=-0.15) USER MOD Single : B 67 HIS : no HD1:sc= -0.868 X(o=-0.87,f=-0.41) USER MOD Single : B 68 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : B 69 HIS : no HD1:sc= -0.265 X(o=-0.27,f=-0.0024) USER MOD Single : B 70 HIS : no HD1:sc= -0.263! C(o=-0.26!,f=-4.5!) USER MOD Single : B 71 HIS : no HD1:sc= -0.385 X(o=-0.38,f=-0.024) USER MOD Single : B 72 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 37.510 -17.501 -5.266 1.00 0.00 N ATOM 2 CA MET A 1 38.136 -18.830 -5.459 1.00 0.00 C ATOM 3 C MET A 1 39.357 -18.987 -4.562 1.00 0.00 C ATOM 4 O MET A 1 39.325 -19.741 -3.589 1.00 0.00 O ATOM 5 CB MET A 1 38.538 -19.043 -6.921 1.00 0.00 C ATOM 6 CG MET A 1 37.360 -19.195 -7.870 1.00 0.00 C ATOM 7 SD MET A 1 37.880 -19.527 -9.564 1.00 0.00 S ATOM 8 CE MET A 1 38.800 -18.036 -9.937 1.00 0.00 C ATOM 0 H1 MET A 1 36.660 -17.428 -5.861 1.00 0.00 H new ATOM 0 H2 MET A 1 37.244 -17.384 -4.267 1.00 0.00 H new ATOM 0 H3 MET A 1 38.186 -16.757 -5.534 1.00 0.00 H new ATOM 0 HA MET A 1 37.397 -19.584 -5.188 1.00 0.00 H new ATOM 0 HB2 MET A 1 39.147 -18.200 -7.246 1.00 0.00 H new ATOM 0 HB3 MET A 1 39.164 -19.933 -6.989 1.00 0.00 H new ATOM 0 HG2 MET A 1 36.720 -20.007 -7.524 1.00 0.00 H new ATOM 0 HG3 MET A 1 36.760 -18.285 -7.849 1.00 0.00 H new ATOM 0 HE1 MET A 1 38.881 -17.919 -11.018 1.00 0.00 H new ATOM 0 HE2 MET A 1 38.282 -17.174 -9.516 1.00 0.00 H new ATOM 0 HE3 MET A 1 39.798 -18.106 -9.504 1.00 0.00 H new ATOM 20 N VAL A 2 40.425 -18.260 -4.872 1.00 0.00 N ATOM 21 CA VAL A 2 41.666 -18.384 -4.125 1.00 0.00 C ATOM 22 C VAL A 2 42.201 -17.009 -3.696 1.00 0.00 C ATOM 23 O VAL A 2 43.103 -16.433 -4.311 1.00 0.00 O ATOM 24 CB VAL A 2 42.731 -19.188 -4.919 1.00 0.00 C ATOM 25 CG1 VAL A 2 43.003 -18.568 -6.285 1.00 0.00 C ATOM 26 CG2 VAL A 2 44.020 -19.334 -4.118 1.00 0.00 C ATOM 0 H VAL A 2 40.454 -17.582 -5.633 1.00 0.00 H new ATOM 0 HA VAL A 2 41.447 -18.946 -3.218 1.00 0.00 H new ATOM 0 HB VAL A 2 42.324 -20.185 -5.088 1.00 0.00 H new ATOM 0 HG11 VAL A 2 43.753 -19.159 -6.810 1.00 0.00 H new ATOM 0 HG12 VAL A 2 42.082 -18.552 -6.867 1.00 0.00 H new ATOM 0 HG13 VAL A 2 43.369 -17.549 -6.156 1.00 0.00 H new ATOM 0 HG21 VAL A 2 44.747 -19.901 -4.699 1.00 0.00 H new ATOM 0 HG22 VAL A 2 44.424 -18.346 -3.896 1.00 0.00 H new ATOM 0 HG23 VAL A 2 43.812 -19.859 -3.186 1.00 0.00 H new ATOM 36 N GLU A 3 41.581 -16.459 -2.665 1.00 0.00 N ATOM 37 CA GLU A 3 42.046 -15.228 -2.042 1.00 0.00 C ATOM 38 C GLU A 3 41.950 -15.376 -0.535 1.00 0.00 C ATOM 39 O GLU A 3 42.956 -15.438 0.165 1.00 0.00 O ATOM 40 CB GLU A 3 41.207 -14.030 -2.496 1.00 0.00 C ATOM 41 CG GLU A 3 41.171 -13.826 -4.002 1.00 0.00 C ATOM 42 CD GLU A 3 40.324 -12.640 -4.398 1.00 0.00 C ATOM 43 OE1 GLU A 3 39.085 -12.731 -4.297 1.00 0.00 O ATOM 44 OE2 GLU A 3 40.893 -11.605 -4.803 1.00 0.00 O ATOM 0 H GLU A 3 40.743 -16.851 -2.236 1.00 0.00 H new ATOM 0 HA GLU A 3 43.079 -15.050 -2.340 1.00 0.00 H new ATOM 0 HB2 GLU A 3 40.187 -14.158 -2.134 1.00 0.00 H new ATOM 0 HB3 GLU A 3 41.601 -13.128 -2.028 1.00 0.00 H new ATOM 0 HG2 GLU A 3 42.186 -13.685 -4.372 1.00 0.00 H new ATOM 0 HG3 GLU A 3 40.780 -14.725 -4.479 1.00 0.00 H new ATOM 51 N ASN A 4 40.721 -15.456 -0.057 1.00 0.00 N ATOM 52 CA ASN A 4 40.442 -15.701 1.347 1.00 0.00 C ATOM 53 C ASN A 4 39.045 -16.282 1.475 1.00 0.00 C ATOM 54 O ASN A 4 38.053 -15.561 1.356 1.00 0.00 O ATOM 55 CB ASN A 4 40.563 -14.410 2.168 1.00 0.00 C ATOM 56 CG ASN A 4 40.289 -14.628 3.649 1.00 0.00 C ATOM 57 OD1 ASN A 4 39.153 -14.514 4.110 1.00 0.00 O ATOM 58 ND2 ASN A 4 41.332 -14.932 4.406 1.00 0.00 N ATOM 0 H ASN A 4 39.886 -15.353 -0.633 1.00 0.00 H new ATOM 0 HA ASN A 4 41.173 -16.408 1.739 1.00 0.00 H new ATOM 0 HB2 ASN A 4 41.565 -13.998 2.045 1.00 0.00 H new ATOM 0 HB3 ASN A 4 39.864 -13.670 1.779 1.00 0.00 H new ATOM 0 HD21 ASN A 4 41.209 -15.080 5.408 1.00 0.00 H new ATOM 0 HD22 ASN A 4 42.258 -15.018 3.987 1.00 0.00 H new ATOM 65 N PRO A 5 38.942 -17.606 1.654 1.00 0.00 N ATOM 66 CA PRO A 5 37.653 -18.282 1.798 1.00 0.00 C ATOM 67 C PRO A 5 36.902 -17.791 3.026 1.00 0.00 C ATOM 68 O PRO A 5 37.245 -18.143 4.158 1.00 0.00 O ATOM 69 CB PRO A 5 38.024 -19.763 1.951 1.00 0.00 C ATOM 70 CG PRO A 5 39.420 -19.873 1.442 1.00 0.00 C ATOM 71 CD PRO A 5 40.069 -18.548 1.730 1.00 0.00 C ATOM 0 HA PRO A 5 36.994 -18.093 0.951 1.00 0.00 H new ATOM 0 HB2 PRO A 5 37.959 -20.079 2.992 1.00 0.00 H new ATOM 0 HB3 PRO A 5 37.346 -20.399 1.382 1.00 0.00 H new ATOM 0 HG2 PRO A 5 39.953 -20.685 1.937 1.00 0.00 H new ATOM 0 HG3 PRO A 5 39.430 -20.089 0.374 1.00 0.00 H new ATOM 0 HD2 PRO A 5 40.541 -18.535 2.712 1.00 0.00 H new ATOM 0 HD3 PRO A 5 40.844 -18.311 1.001 1.00 0.00 H new ATOM 79 N MET A 6 35.895 -16.956 2.800 1.00 0.00 N ATOM 80 CA MET A 6 35.113 -16.390 3.890 1.00 0.00 C ATOM 81 C MET A 6 34.165 -17.432 4.477 1.00 0.00 C ATOM 82 O MET A 6 32.955 -17.405 4.251 1.00 0.00 O ATOM 83 CB MET A 6 34.348 -15.136 3.429 1.00 0.00 C ATOM 84 CG MET A 6 33.492 -15.339 2.184 1.00 0.00 C ATOM 85 SD MET A 6 32.626 -13.836 1.677 1.00 0.00 S ATOM 86 CE MET A 6 31.616 -13.514 3.124 1.00 0.00 C ATOM 0 H MET A 6 35.601 -16.656 1.870 1.00 0.00 H new ATOM 0 HA MET A 6 35.802 -16.085 4.677 1.00 0.00 H new ATOM 0 HB2 MET A 6 33.708 -14.797 4.243 1.00 0.00 H new ATOM 0 HB3 MET A 6 35.066 -14.339 3.235 1.00 0.00 H new ATOM 0 HG2 MET A 6 34.125 -15.682 1.365 1.00 0.00 H new ATOM 0 HG3 MET A 6 32.763 -16.126 2.374 1.00 0.00 H new ATOM 0 HE1 MET A 6 30.778 -12.874 2.848 1.00 0.00 H new ATOM 0 HE2 MET A 6 31.238 -14.456 3.521 1.00 0.00 H new ATOM 0 HE3 MET A 6 32.218 -13.016 3.884 1.00 0.00 H new ATOM 96 N VAL A 7 34.742 -18.375 5.207 1.00 0.00 N ATOM 97 CA VAL A 7 33.970 -19.402 5.884 1.00 0.00 C ATOM 98 C VAL A 7 33.501 -18.899 7.239 1.00 0.00 C ATOM 99 O VAL A 7 32.596 -19.465 7.849 1.00 0.00 O ATOM 100 CB VAL A 7 34.784 -20.701 6.069 1.00 0.00 C ATOM 101 CG1 VAL A 7 35.127 -21.312 4.719 1.00 0.00 C ATOM 102 CG2 VAL A 7 36.049 -20.439 6.878 1.00 0.00 C ATOM 0 H VAL A 7 35.750 -18.449 5.345 1.00 0.00 H new ATOM 0 HA VAL A 7 33.108 -19.628 5.257 1.00 0.00 H new ATOM 0 HB VAL A 7 34.170 -21.411 6.623 1.00 0.00 H new ATOM 0 HG11 VAL A 7 35.701 -22.227 4.869 1.00 0.00 H new ATOM 0 HG12 VAL A 7 34.208 -21.544 4.181 1.00 0.00 H new ATOM 0 HG13 VAL A 7 35.718 -20.604 4.139 1.00 0.00 H new ATOM 0 HG21 VAL A 7 36.605 -21.369 6.995 1.00 0.00 H new ATOM 0 HG22 VAL A 7 36.669 -19.708 6.358 1.00 0.00 H new ATOM 0 HG23 VAL A 7 35.779 -20.052 7.861 1.00 0.00 H new ATOM 112 N ILE A 8 34.121 -17.824 7.699 1.00 0.00 N ATOM 113 CA ILE A 8 33.762 -17.238 8.976 1.00 0.00 C ATOM 114 C ILE A 8 33.375 -15.768 8.824 1.00 0.00 C ATOM 115 O ILE A 8 34.225 -14.879 8.779 1.00 0.00 O ATOM 116 CB ILE A 8 34.895 -17.395 10.025 1.00 0.00 C ATOM 117 CG1 ILE A 8 34.541 -16.641 11.317 1.00 0.00 C ATOM 118 CG2 ILE A 8 36.236 -16.930 9.463 1.00 0.00 C ATOM 119 CD1 ILE A 8 35.590 -16.760 12.403 1.00 0.00 C ATOM 0 H ILE A 8 34.873 -17.342 7.207 1.00 0.00 H new ATOM 0 HA ILE A 8 32.893 -17.786 9.341 1.00 0.00 H new ATOM 0 HB ILE A 8 34.992 -18.454 10.265 1.00 0.00 H new ATOM 0 HG12 ILE A 8 34.393 -15.587 11.082 1.00 0.00 H new ATOM 0 HG13 ILE A 8 33.592 -17.019 11.698 1.00 0.00 H new ATOM 0 HG21 ILE A 8 37.010 -17.052 10.221 1.00 0.00 H new ATOM 0 HG22 ILE A 8 36.489 -17.526 8.586 1.00 0.00 H new ATOM 0 HG23 ILE A 8 36.167 -15.880 9.180 1.00 0.00 H new ATOM 0 HD11 ILE A 8 35.268 -16.202 13.282 1.00 0.00 H new ATOM 0 HD12 ILE A 8 35.722 -17.809 12.668 1.00 0.00 H new ATOM 0 HD13 ILE A 8 36.535 -16.355 12.042 1.00 0.00 H new ATOM 131 N ASN A 9 32.085 -15.529 8.693 1.00 0.00 N ATOM 132 CA ASN A 9 31.548 -14.178 8.747 1.00 0.00 C ATOM 133 C ASN A 9 30.660 -14.074 9.974 1.00 0.00 C ATOM 134 O ASN A 9 29.444 -14.265 9.900 1.00 0.00 O ATOM 135 CB ASN A 9 30.765 -13.843 7.472 1.00 0.00 C ATOM 136 CG ASN A 9 30.289 -12.398 7.425 1.00 0.00 C ATOM 137 OD1 ASN A 9 31.001 -11.510 6.954 1.00 0.00 O ATOM 138 ND2 ASN A 9 29.074 -12.156 7.895 1.00 0.00 N ATOM 0 H ASN A 9 31.384 -16.255 8.548 1.00 0.00 H new ATOM 0 HA ASN A 9 32.363 -13.458 8.815 1.00 0.00 H new ATOM 0 HB2 ASN A 9 31.394 -14.040 6.604 1.00 0.00 H new ATOM 0 HB3 ASN A 9 29.903 -14.506 7.398 1.00 0.00 H new ATOM 0 HD21 ASN A 9 28.699 -11.208 7.874 1.00 0.00 H new ATOM 0 HD22 ASN A 9 28.514 -12.918 8.277 1.00 0.00 H new ATOM 145 N ASN A 10 31.284 -13.819 11.113 1.00 0.00 N ATOM 146 CA ASN A 10 30.595 -13.906 12.392 1.00 0.00 C ATOM 147 C ASN A 10 30.333 -12.526 12.979 1.00 0.00 C ATOM 148 O ASN A 10 31.086 -11.581 12.744 1.00 0.00 O ATOM 149 CB ASN A 10 31.423 -14.748 13.373 1.00 0.00 C ATOM 150 CG ASN A 10 30.696 -15.026 14.675 1.00 0.00 C ATOM 151 OD1 ASN A 10 29.471 -15.128 14.709 1.00 0.00 O ATOM 152 ND2 ASN A 10 31.450 -15.170 15.753 1.00 0.00 N ATOM 0 H ASN A 10 32.266 -13.550 11.179 1.00 0.00 H new ATOM 0 HA ASN A 10 29.630 -14.385 12.225 1.00 0.00 H new ATOM 0 HB2 ASN A 10 31.684 -15.695 12.900 1.00 0.00 H new ATOM 0 HB3 ASN A 10 32.358 -14.230 13.588 1.00 0.00 H new ATOM 0 HD21 ASN A 10 31.018 -15.373 16.654 1.00 0.00 H new ATOM 0 HD22 ASN A 10 32.463 -15.078 15.683 1.00 0.00 H new ATOM 159 N TRP A 11 29.255 -12.422 13.739 1.00 0.00 N ATOM 160 CA TRP A 11 28.898 -11.182 14.406 1.00 0.00 C ATOM 161 C TRP A 11 29.846 -10.916 15.573 1.00 0.00 C ATOM 162 O TRP A 11 30.132 -11.810 16.370 1.00 0.00 O ATOM 163 CB TRP A 11 27.440 -11.236 14.888 1.00 0.00 C ATOM 164 CG TRP A 11 27.083 -12.500 15.622 1.00 0.00 C ATOM 165 CD1 TRP A 11 26.663 -13.674 15.070 1.00 0.00 C ATOM 166 CD2 TRP A 11 27.104 -12.710 17.039 1.00 0.00 C ATOM 167 NE1 TRP A 11 26.439 -14.606 16.051 1.00 0.00 N ATOM 168 CE2 TRP A 11 26.700 -14.038 17.269 1.00 0.00 C ATOM 169 CE3 TRP A 11 27.434 -11.907 18.133 1.00 0.00 C ATOM 170 CZ2 TRP A 11 26.613 -14.580 18.547 1.00 0.00 C ATOM 171 CZ3 TRP A 11 27.347 -12.446 19.401 1.00 0.00 C ATOM 172 CH2 TRP A 11 26.942 -13.771 19.598 1.00 0.00 C ATOM 0 H TRP A 11 28.606 -13.190 13.910 1.00 0.00 H new ATOM 0 HA TRP A 11 28.992 -10.361 13.695 1.00 0.00 H new ATOM 0 HB2 TRP A 11 27.253 -10.384 15.541 1.00 0.00 H new ATOM 0 HB3 TRP A 11 26.780 -11.129 14.027 1.00 0.00 H new ATOM 0 HD1 TRP A 11 26.526 -13.845 14.012 1.00 0.00 H new ATOM 0 HE1 TRP A 11 26.129 -15.566 15.898 1.00 0.00 H new ATOM 0 HE3 TRP A 11 27.751 -10.885 17.990 1.00 0.00 H new ATOM 0 HZ2 TRP A 11 26.298 -15.601 18.703 1.00 0.00 H new ATOM 0 HZ3 TRP A 11 27.596 -11.835 20.256 1.00 0.00 H new ATOM 0 HH2 TRP A 11 26.888 -14.163 20.603 1.00 0.00 H new ATOM 183 N HIS A 12 30.362 -9.696 15.649 1.00 0.00 N ATOM 184 CA HIS A 12 31.311 -9.333 16.700 1.00 0.00 C ATOM 185 C HIS A 12 30.954 -7.983 17.311 1.00 0.00 C ATOM 186 O HIS A 12 31.446 -7.630 18.383 1.00 0.00 O ATOM 187 CB HIS A 12 32.745 -9.274 16.150 1.00 0.00 C ATOM 188 CG HIS A 12 33.223 -10.550 15.521 1.00 0.00 C ATOM 189 ND1 HIS A 12 33.729 -10.607 14.242 1.00 0.00 N ATOM 190 CD2 HIS A 12 33.291 -11.812 16.006 1.00 0.00 C ATOM 191 CE1 HIS A 12 34.088 -11.846 13.967 1.00 0.00 C ATOM 192 NE2 HIS A 12 33.833 -12.599 15.019 1.00 0.00 N ATOM 0 H HIS A 12 30.142 -8.941 14.999 1.00 0.00 H new ATOM 0 HA HIS A 12 31.255 -10.103 17.470 1.00 0.00 H new ATOM 0 HB2 HIS A 12 32.805 -8.475 15.411 1.00 0.00 H new ATOM 0 HB3 HIS A 12 33.422 -9.008 16.962 1.00 0.00 H new ATOM 0 HD2 HIS A 12 32.978 -12.139 16.986 1.00 0.00 H new ATOM 0 HE1 HIS A 12 34.518 -12.186 13.037 1.00 0.00 H new ATOM 0 HE2 HIS A 12 34.009 -13.601 15.089 1.00 0.00 H new ATOM 201 N ASP A 13 30.084 -7.246 16.631 1.00 0.00 N ATOM 202 CA ASP A 13 29.730 -5.884 17.028 1.00 0.00 C ATOM 203 C ASP A 13 28.676 -5.340 16.077 1.00 0.00 C ATOM 204 O ASP A 13 27.592 -4.928 16.490 1.00 0.00 O ATOM 205 CB ASP A 13 30.965 -4.976 17.006 1.00 0.00 C ATOM 206 CG ASP A 13 30.657 -3.556 17.448 1.00 0.00 C ATOM 207 OD1 ASP A 13 30.650 -3.295 18.666 1.00 0.00 O ATOM 208 OD2 ASP A 13 30.434 -2.686 16.580 1.00 0.00 O ATOM 0 H ASP A 13 29.604 -7.572 15.792 1.00 0.00 H new ATOM 0 HA ASP A 13 29.335 -5.905 18.044 1.00 0.00 H new ATOM 0 HB2 ASP A 13 31.732 -5.396 17.657 1.00 0.00 H new ATOM 0 HB3 ASP A 13 31.379 -4.957 15.998 1.00 0.00 H new ATOM 213 N LYS A 14 29.011 -5.368 14.794 1.00 0.00 N ATOM 214 CA LYS A 14 28.112 -4.940 13.734 1.00 0.00 C ATOM 215 C LYS A 14 28.613 -5.460 12.394 1.00 0.00 C ATOM 216 O LYS A 14 29.623 -6.165 12.332 1.00 0.00 O ATOM 217 CB LYS A 14 28.006 -3.413 13.691 1.00 0.00 C ATOM 218 CG LYS A 14 29.353 -2.710 13.630 1.00 0.00 C ATOM 219 CD LYS A 14 29.192 -1.215 13.418 1.00 0.00 C ATOM 220 CE LYS A 14 30.488 -0.477 13.699 1.00 0.00 C ATOM 221 NZ LYS A 14 30.812 -0.463 15.148 1.00 0.00 N ATOM 0 H LYS A 14 29.919 -5.690 14.459 1.00 0.00 H new ATOM 0 HA LYS A 14 27.122 -5.348 13.937 1.00 0.00 H new ATOM 0 HB2 LYS A 14 27.415 -3.123 12.823 1.00 0.00 H new ATOM 0 HB3 LYS A 14 27.466 -3.070 14.574 1.00 0.00 H new ATOM 0 HG2 LYS A 14 29.901 -2.890 14.555 1.00 0.00 H new ATOM 0 HG3 LYS A 14 29.948 -3.131 12.820 1.00 0.00 H new ATOM 0 HD2 LYS A 14 28.876 -1.023 12.393 1.00 0.00 H new ATOM 0 HD3 LYS A 14 28.406 -0.835 14.070 1.00 0.00 H new ATOM 0 HE2 LYS A 14 31.302 -0.950 13.149 1.00 0.00 H new ATOM 0 HE3 LYS A 14 30.409 0.547 13.334 1.00 0.00 H new ATOM 0 HZ1 LYS A 14 31.637 0.148 15.313 1.00 0.00 H new ATOM 0 HZ2 LYS A 14 29.998 -0.098 15.682 1.00 0.00 H new ATOM 0 HZ3 LYS A 14 31.029 -1.430 15.465 1.00 0.00 H new ATOM 235 N LEU A 15 27.909 -5.111 11.328 1.00 0.00 N ATOM 236 CA LEU A 15 28.320 -5.486 9.985 1.00 0.00 C ATOM 237 C LEU A 15 28.550 -4.235 9.146 1.00 0.00 C ATOM 238 O LEU A 15 28.188 -3.130 9.558 1.00 0.00 O ATOM 239 CB LEU A 15 27.290 -6.406 9.308 1.00 0.00 C ATOM 240 CG LEU A 15 25.921 -5.787 9.000 1.00 0.00 C ATOM 241 CD1 LEU A 15 25.178 -6.653 7.998 1.00 0.00 C ATOM 242 CD2 LEU A 15 25.090 -5.633 10.265 1.00 0.00 C ATOM 0 H LEU A 15 27.047 -4.567 11.368 1.00 0.00 H new ATOM 0 HA LEU A 15 29.252 -6.045 10.063 1.00 0.00 H new ATOM 0 HB2 LEU A 15 27.718 -6.769 8.374 1.00 0.00 H new ATOM 0 HB3 LEU A 15 27.136 -7.275 9.947 1.00 0.00 H new ATOM 0 HG LEU A 15 26.083 -4.796 8.577 1.00 0.00 H new ATOM 0 HD11 LEU A 15 24.206 -6.208 7.783 1.00 0.00 H new ATOM 0 HD12 LEU A 15 25.757 -6.722 7.077 1.00 0.00 H new ATOM 0 HD13 LEU A 15 25.037 -7.651 8.414 1.00 0.00 H new ATOM 0 HD21 LEU A 15 24.125 -5.192 10.015 1.00 0.00 H new ATOM 0 HD22 LEU A 15 24.935 -6.611 10.720 1.00 0.00 H new ATOM 0 HD23 LEU A 15 25.614 -4.985 10.968 1.00 0.00 H new ATOM 254 N THR A 16 29.145 -4.407 7.976 1.00 0.00 N ATOM 255 CA THR A 16 29.482 -3.277 7.123 1.00 0.00 C ATOM 256 C THR A 16 28.296 -2.880 6.239 1.00 0.00 C ATOM 257 O THR A 16 27.195 -3.424 6.381 1.00 0.00 O ATOM 258 CB THR A 16 30.722 -3.586 6.249 1.00 0.00 C ATOM 259 OG1 THR A 16 31.215 -2.385 5.638 1.00 0.00 O ATOM 260 CG2 THR A 16 30.401 -4.621 5.174 1.00 0.00 C ATOM 0 H THR A 16 29.404 -5.317 7.595 1.00 0.00 H new ATOM 0 HA THR A 16 29.722 -2.437 7.774 1.00 0.00 H new ATOM 0 HB THR A 16 31.492 -3.999 6.901 1.00 0.00 H new ATOM 0 HG1 THR A 16 31.077 -1.628 6.245 1.00 0.00 H new ATOM 0 HG21 THR A 16 31.293 -4.815 4.578 1.00 0.00 H new ATOM 0 HG22 THR A 16 30.072 -5.546 5.647 1.00 0.00 H new ATOM 0 HG23 THR A 16 29.609 -4.242 4.529 1.00 0.00 H new ATOM 268 N GLU A 17 28.548 -1.942 5.324 1.00 0.00 N ATOM 269 CA GLU A 17 27.512 -1.347 4.477 1.00 0.00 C ATOM 270 C GLU A 17 26.515 -0.561 5.313 1.00 0.00 C ATOM 271 O GLU A 17 25.558 -1.114 5.855 1.00 0.00 O ATOM 272 CB GLU A 17 26.777 -2.400 3.649 1.00 0.00 C ATOM 273 CG GLU A 17 27.593 -2.963 2.502 1.00 0.00 C ATOM 274 CD GLU A 17 27.797 -1.953 1.397 1.00 0.00 C ATOM 275 OE1 GLU A 17 26.798 -1.579 0.741 1.00 0.00 O ATOM 276 OE2 GLU A 17 28.948 -1.523 1.182 1.00 0.00 O ATOM 0 H GLU A 17 29.482 -1.572 5.149 1.00 0.00 H new ATOM 0 HA GLU A 17 28.016 -0.668 3.789 1.00 0.00 H new ATOM 0 HB2 GLU A 17 26.477 -3.218 4.304 1.00 0.00 H new ATOM 0 HB3 GLU A 17 25.863 -1.960 3.250 1.00 0.00 H new ATOM 0 HG2 GLU A 17 28.563 -3.291 2.875 1.00 0.00 H new ATOM 0 HG3 GLU A 17 27.092 -3.843 2.099 1.00 0.00 H new ATOM 283 N THR A 18 26.748 0.732 5.420 1.00 0.00 N ATOM 284 CA THR A 18 25.898 1.595 6.214 1.00 0.00 C ATOM 285 C THR A 18 25.188 2.621 5.342 1.00 0.00 C ATOM 286 O THR A 18 23.964 2.747 5.375 1.00 0.00 O ATOM 287 CB THR A 18 26.719 2.342 7.278 1.00 0.00 C ATOM 288 OG1 THR A 18 27.331 1.407 8.178 1.00 0.00 O ATOM 289 CG2 THR A 18 25.842 3.315 8.047 1.00 0.00 C ATOM 0 H THR A 18 27.525 1.210 4.963 1.00 0.00 H new ATOM 0 HA THR A 18 25.159 0.958 6.699 1.00 0.00 H new ATOM 0 HB THR A 18 27.501 2.910 6.774 1.00 0.00 H new ATOM 0 HG1 THR A 18 27.853 1.893 8.850 1.00 0.00 H new ATOM 0 HG21 THR A 18 26.442 3.833 8.795 1.00 0.00 H new ATOM 0 HG22 THR A 18 25.414 4.043 7.357 1.00 0.00 H new ATOM 0 HG23 THR A 18 25.039 2.768 8.542 1.00 0.00 H new ATOM 297 N ASP A 19 25.964 3.335 4.549 1.00 0.00 N ATOM 298 CA ASP A 19 25.452 4.473 3.803 1.00 0.00 C ATOM 299 C ASP A 19 25.923 4.393 2.363 1.00 0.00 C ATOM 300 O ASP A 19 26.763 5.174 1.910 1.00 0.00 O ATOM 301 CB ASP A 19 25.902 5.788 4.455 1.00 0.00 C ATOM 302 CG ASP A 19 25.279 7.017 3.817 1.00 0.00 C ATOM 303 OD1 ASP A 19 24.051 7.208 3.950 1.00 0.00 O ATOM 304 OD2 ASP A 19 26.021 7.813 3.205 1.00 0.00 O ATOM 0 H ASP A 19 26.956 3.147 4.403 1.00 0.00 H new ATOM 0 HA ASP A 19 24.362 4.449 3.816 1.00 0.00 H new ATOM 0 HB2 ASP A 19 25.645 5.767 5.514 1.00 0.00 H new ATOM 0 HB3 ASP A 19 26.987 5.865 4.391 1.00 0.00 H new ATOM 309 N VAL A 20 25.422 3.390 1.667 1.00 0.00 N ATOM 310 CA VAL A 20 25.731 3.210 0.256 1.00 0.00 C ATOM 311 C VAL A 20 24.462 3.328 -0.573 1.00 0.00 C ATOM 312 O VAL A 20 23.437 2.724 -0.250 1.00 0.00 O ATOM 313 CB VAL A 20 26.402 1.851 -0.027 1.00 0.00 C ATOM 314 CG1 VAL A 20 26.829 1.761 -1.486 1.00 0.00 C ATOM 315 CG2 VAL A 20 27.593 1.641 0.890 1.00 0.00 C ATOM 0 H VAL A 20 24.797 2.684 2.055 1.00 0.00 H new ATOM 0 HA VAL A 20 26.436 3.994 -0.021 1.00 0.00 H new ATOM 0 HB VAL A 20 25.676 1.062 0.169 1.00 0.00 H new ATOM 0 HG11 VAL A 20 27.301 0.795 -1.668 1.00 0.00 H new ATOM 0 HG12 VAL A 20 25.954 1.864 -2.128 1.00 0.00 H new ATOM 0 HG13 VAL A 20 27.538 2.559 -1.707 1.00 0.00 H new ATOM 0 HG21 VAL A 20 28.053 0.676 0.674 1.00 0.00 H new ATOM 0 HG22 VAL A 20 28.322 2.435 0.727 1.00 0.00 H new ATOM 0 HG23 VAL A 20 27.261 1.661 1.928 1.00 0.00 H new ATOM 325 N GLN A 21 24.538 4.112 -1.636 1.00 0.00 N ATOM 326 CA GLN A 21 23.385 4.399 -2.470 1.00 0.00 C ATOM 327 C GLN A 21 23.798 4.458 -3.934 1.00 0.00 C ATOM 328 O GLN A 21 24.973 4.642 -4.243 1.00 0.00 O ATOM 329 CB GLN A 21 22.759 5.727 -2.035 1.00 0.00 C ATOM 330 CG GLN A 21 23.776 6.845 -1.886 1.00 0.00 C ATOM 331 CD GLN A 21 23.203 8.095 -1.253 1.00 0.00 C ATOM 332 OE1 GLN A 21 23.199 8.241 -0.035 1.00 0.00 O ATOM 333 NE2 GLN A 21 22.736 9.015 -2.076 1.00 0.00 N ATOM 0 H GLN A 21 25.398 4.566 -1.943 1.00 0.00 H new ATOM 0 HA GLN A 21 22.648 3.604 -2.354 1.00 0.00 H new ATOM 0 HB2 GLN A 21 22.006 6.024 -2.766 1.00 0.00 H new ATOM 0 HB3 GLN A 21 22.243 5.585 -1.086 1.00 0.00 H new ATOM 0 HG2 GLN A 21 24.610 6.490 -1.281 1.00 0.00 H new ATOM 0 HG3 GLN A 21 24.178 7.095 -2.868 1.00 0.00 H new ATOM 0 HE21 GLN A 21 22.757 8.856 -3.083 1.00 0.00 H new ATOM 0 HE22 GLN A 21 22.354 9.885 -1.705 1.00 0.00 H new ATOM 342 N ILE A 22 22.841 4.291 -4.832 1.00 0.00 N ATOM 343 CA ILE A 22 23.124 4.345 -6.262 1.00 0.00 C ATOM 344 C ILE A 22 22.102 5.225 -6.973 1.00 0.00 C ATOM 345 O ILE A 22 20.957 5.333 -6.534 1.00 0.00 O ATOM 346 CB ILE A 22 23.118 2.940 -6.910 1.00 0.00 C ATOM 347 CG1 ILE A 22 24.101 2.010 -6.200 1.00 0.00 C ATOM 348 CG2 ILE A 22 23.477 3.026 -8.385 1.00 0.00 C ATOM 349 CD1 ILE A 22 24.229 0.656 -6.864 1.00 0.00 C ATOM 0 H ILE A 22 21.863 4.117 -4.600 1.00 0.00 H new ATOM 0 HA ILE A 22 24.123 4.768 -6.371 1.00 0.00 H new ATOM 0 HB ILE A 22 22.111 2.534 -6.811 1.00 0.00 H new ATOM 0 HG12 ILE A 22 25.081 2.485 -6.167 1.00 0.00 H new ATOM 0 HG13 ILE A 22 23.779 1.872 -5.168 1.00 0.00 H new ATOM 0 HG21 ILE A 22 23.467 2.027 -8.821 1.00 0.00 H new ATOM 0 HG22 ILE A 22 22.750 3.654 -8.900 1.00 0.00 H new ATOM 0 HG23 ILE A 22 24.472 3.459 -8.493 1.00 0.00 H new ATOM 0 HD11 ILE A 22 24.942 0.045 -6.310 1.00 0.00 H new ATOM 0 HD12 ILE A 22 23.258 0.162 -6.873 1.00 0.00 H new ATOM 0 HD13 ILE A 22 24.580 0.785 -7.888 1.00 0.00 H new ATOM 361 N ASP A 23 22.530 5.869 -8.057 1.00 0.00 N ATOM 362 CA ASP A 23 21.651 6.691 -8.861 1.00 0.00 C ATOM 363 C ASP A 23 20.788 5.819 -9.779 1.00 0.00 C ATOM 364 O ASP A 23 20.778 4.590 -9.668 1.00 0.00 O ATOM 365 CB ASP A 23 22.479 7.672 -9.698 1.00 0.00 C ATOM 366 CG ASP A 23 23.130 7.012 -10.896 1.00 0.00 C ATOM 367 OD1 ASP A 23 23.927 6.067 -10.707 1.00 0.00 O ATOM 368 OD2 ASP A 23 22.832 7.442 -12.031 1.00 0.00 O ATOM 0 H ASP A 23 23.492 5.831 -8.395 1.00 0.00 H new ATOM 0 HA ASP A 23 20.993 7.251 -8.197 1.00 0.00 H new ATOM 0 HB2 ASP A 23 21.837 8.484 -10.040 1.00 0.00 H new ATOM 0 HB3 ASP A 23 23.250 8.118 -9.070 1.00 0.00 H new ATOM 373 N PHE A 24 20.076 6.463 -10.689 1.00 0.00 N ATOM 374 CA PHE A 24 19.161 5.779 -11.588 1.00 0.00 C ATOM 375 C PHE A 24 19.912 4.971 -12.646 1.00 0.00 C ATOM 376 O PHE A 24 19.406 3.962 -13.136 1.00 0.00 O ATOM 377 CB PHE A 24 18.241 6.804 -12.260 1.00 0.00 C ATOM 378 CG PHE A 24 17.238 6.200 -13.203 1.00 0.00 C ATOM 379 CD1 PHE A 24 16.096 5.585 -12.718 1.00 0.00 C ATOM 380 CD2 PHE A 24 17.440 6.244 -14.574 1.00 0.00 C ATOM 381 CE1 PHE A 24 15.175 5.028 -13.581 1.00 0.00 C ATOM 382 CE2 PHE A 24 16.523 5.687 -15.443 1.00 0.00 C ATOM 383 CZ PHE A 24 15.389 5.077 -14.946 1.00 0.00 C ATOM 0 H PHE A 24 20.116 7.473 -10.825 1.00 0.00 H new ATOM 0 HA PHE A 24 18.565 5.080 -11.001 1.00 0.00 H new ATOM 0 HB2 PHE A 24 17.709 7.361 -11.488 1.00 0.00 H new ATOM 0 HB3 PHE A 24 18.852 7.522 -12.807 1.00 0.00 H new ATOM 0 HD1 PHE A 24 15.924 5.541 -11.653 1.00 0.00 H new ATOM 0 HD2 PHE A 24 18.326 6.720 -14.967 1.00 0.00 H new ATOM 0 HE1 PHE A 24 14.287 4.554 -13.190 1.00 0.00 H new ATOM 0 HE2 PHE A 24 16.693 5.729 -16.509 1.00 0.00 H new ATOM 0 HZ PHE A 24 14.670 4.639 -15.622 1.00 0.00 H new ATOM 393 N TYR A 25 21.117 5.405 -12.988 1.00 0.00 N ATOM 394 CA TYR A 25 21.871 4.778 -14.067 1.00 0.00 C ATOM 395 C TYR A 25 22.680 3.582 -13.572 1.00 0.00 C ATOM 396 O TYR A 25 23.258 2.847 -14.371 1.00 0.00 O ATOM 397 CB TYR A 25 22.774 5.807 -14.749 1.00 0.00 C ATOM 398 CG TYR A 25 22.021 6.761 -15.655 1.00 0.00 C ATOM 399 CD1 TYR A 25 20.980 7.547 -15.169 1.00 0.00 C ATOM 400 CD2 TYR A 25 22.340 6.863 -17.002 1.00 0.00 C ATOM 401 CE1 TYR A 25 20.286 8.407 -15.999 1.00 0.00 C ATOM 402 CE2 TYR A 25 21.651 7.721 -17.836 1.00 0.00 C ATOM 403 CZ TYR A 25 20.625 8.489 -17.331 1.00 0.00 C ATOM 404 OH TYR A 25 19.934 9.346 -18.164 1.00 0.00 O ATOM 0 H TYR A 25 21.593 6.186 -12.536 1.00 0.00 H new ATOM 0 HA TYR A 25 21.157 4.400 -14.799 1.00 0.00 H new ATOM 0 HB2 TYR A 25 23.300 6.381 -13.986 1.00 0.00 H new ATOM 0 HB3 TYR A 25 23.532 5.284 -15.333 1.00 0.00 H new ATOM 0 HD1 TYR A 25 20.710 7.484 -14.125 1.00 0.00 H new ATOM 0 HD2 TYR A 25 23.141 6.261 -17.405 1.00 0.00 H new ATOM 0 HE1 TYR A 25 19.482 9.011 -15.605 1.00 0.00 H new ATOM 0 HE2 TYR A 25 21.916 7.790 -18.881 1.00 0.00 H new ATOM 0 HH TYR A 25 20.298 9.285 -19.072 1.00 0.00 H new ATOM 414 N GLY A 26 22.723 3.389 -12.260 1.00 0.00 N ATOM 415 CA GLY A 26 23.331 2.195 -11.715 1.00 0.00 C ATOM 416 C GLY A 26 24.841 2.270 -11.657 1.00 0.00 C ATOM 417 O GLY A 26 25.527 1.290 -11.950 1.00 0.00 O ATOM 0 H GLY A 26 22.348 4.037 -11.567 1.00 0.00 H new ATOM 0 HA2 GLY A 26 22.943 2.023 -10.711 1.00 0.00 H new ATOM 0 HA3 GLY A 26 23.039 1.337 -12.321 1.00 0.00 H new ATOM 421 N ASP A 27 25.366 3.433 -11.298 1.00 0.00 N ATOM 422 CA ASP A 27 26.802 3.581 -11.099 1.00 0.00 C ATOM 423 C ASP A 27 27.123 3.416 -9.616 1.00 0.00 C ATOM 424 O ASP A 27 27.364 2.301 -9.147 1.00 0.00 O ATOM 425 CB ASP A 27 27.286 4.942 -11.612 1.00 0.00 C ATOM 426 CG ASP A 27 28.797 5.064 -11.616 1.00 0.00 C ATOM 427 OD1 ASP A 27 29.366 5.497 -10.595 1.00 0.00 O ATOM 428 OD2 ASP A 27 29.420 4.740 -12.648 1.00 0.00 O ATOM 0 H ASP A 27 24.824 4.283 -11.139 1.00 0.00 H new ATOM 0 HA ASP A 27 27.324 2.811 -11.667 1.00 0.00 H new ATOM 0 HB2 ASP A 27 26.911 5.099 -12.623 1.00 0.00 H new ATOM 0 HB3 ASP A 27 26.864 5.731 -10.990 1.00 0.00 H new ATOM 433 N GLU A 28 27.098 4.527 -8.889 1.00 0.00 N ATOM 434 CA GLU A 28 27.202 4.530 -7.432 1.00 0.00 C ATOM 435 C GLU A 28 27.225 5.964 -6.935 1.00 0.00 C ATOM 436 O GLU A 28 27.822 6.840 -7.564 1.00 0.00 O ATOM 437 CB GLU A 28 28.453 3.804 -6.926 1.00 0.00 C ATOM 438 CG GLU A 28 28.367 3.434 -5.454 1.00 0.00 C ATOM 439 CD GLU A 28 29.559 2.633 -4.980 1.00 0.00 C ATOM 440 OE1 GLU A 28 29.526 1.389 -5.104 1.00 0.00 O ATOM 441 OE2 GLU A 28 30.527 3.239 -4.479 1.00 0.00 O ATOM 0 H GLU A 28 27.004 5.458 -9.295 1.00 0.00 H new ATOM 0 HA GLU A 28 26.335 3.995 -7.044 1.00 0.00 H new ATOM 0 HB2 GLU A 28 28.605 2.899 -7.515 1.00 0.00 H new ATOM 0 HB3 GLU A 28 29.325 4.438 -7.086 1.00 0.00 H new ATOM 0 HG2 GLU A 28 28.287 4.344 -4.859 1.00 0.00 H new ATOM 0 HG3 GLU A 28 27.457 2.859 -5.281 1.00 0.00 H new ATOM 448 N VAL A 29 26.574 6.200 -5.815 1.00 0.00 N ATOM 449 CA VAL A 29 26.513 7.527 -5.240 1.00 0.00 C ATOM 450 C VAL A 29 27.071 7.522 -3.826 1.00 0.00 C ATOM 451 O VAL A 29 26.605 6.780 -2.964 1.00 0.00 O ATOM 452 CB VAL A 29 25.070 8.066 -5.212 1.00 0.00 C ATOM 453 CG1 VAL A 29 25.027 9.450 -4.595 1.00 0.00 C ATOM 454 CG2 VAL A 29 24.483 8.096 -6.611 1.00 0.00 C ATOM 0 H VAL A 29 26.077 5.486 -5.283 1.00 0.00 H new ATOM 0 HA VAL A 29 27.117 8.180 -5.871 1.00 0.00 H new ATOM 0 HB VAL A 29 24.470 7.395 -4.598 1.00 0.00 H new ATOM 0 HG11 VAL A 29 23.999 9.812 -4.585 1.00 0.00 H new ATOM 0 HG12 VAL A 29 25.406 9.405 -3.574 1.00 0.00 H new ATOM 0 HG13 VAL A 29 25.645 10.129 -5.182 1.00 0.00 H new ATOM 0 HG21 VAL A 29 23.464 8.480 -6.570 1.00 0.00 H new ATOM 0 HG22 VAL A 29 25.089 8.743 -7.246 1.00 0.00 H new ATOM 0 HG23 VAL A 29 24.475 7.087 -7.024 1.00 0.00 H new ATOM 464 N THR A 30 28.092 8.325 -3.609 1.00 0.00 N ATOM 465 CA THR A 30 28.643 8.517 -2.287 1.00 0.00 C ATOM 466 C THR A 30 28.476 9.988 -1.897 1.00 0.00 C ATOM 467 O THR A 30 28.211 10.823 -2.760 1.00 0.00 O ATOM 468 CB THR A 30 30.131 8.097 -2.241 1.00 0.00 C ATOM 469 OG1 THR A 30 30.895 8.867 -3.176 1.00 0.00 O ATOM 470 CG2 THR A 30 30.283 6.615 -2.564 1.00 0.00 C ATOM 0 H THR A 30 28.560 8.860 -4.341 1.00 0.00 H new ATOM 0 HA THR A 30 28.110 7.888 -1.574 1.00 0.00 H new ATOM 0 HB THR A 30 30.502 8.281 -1.233 1.00 0.00 H new ATOM 0 HG1 THR A 30 30.469 8.828 -4.058 1.00 0.00 H new ATOM 0 HG21 THR A 30 31.337 6.341 -2.526 1.00 0.00 H new ATOM 0 HG22 THR A 30 29.728 6.025 -1.835 1.00 0.00 H new ATOM 0 HG23 THR A 30 29.893 6.418 -3.562 1.00 0.00 H new ATOM 478 N PRO A 31 28.591 10.323 -0.604 1.00 0.00 N ATOM 479 CA PRO A 31 28.428 11.709 -0.116 1.00 0.00 C ATOM 480 C PRO A 31 29.375 12.720 -0.768 1.00 0.00 C ATOM 481 O PRO A 31 29.206 13.927 -0.599 1.00 0.00 O ATOM 482 CB PRO A 31 28.723 11.601 1.382 1.00 0.00 C ATOM 483 CG PRO A 31 28.482 10.170 1.723 1.00 0.00 C ATOM 484 CD PRO A 31 28.835 9.378 0.496 1.00 0.00 C ATOM 0 HA PRO A 31 27.433 12.084 -0.356 1.00 0.00 H new ATOM 0 HB2 PRO A 31 29.750 11.891 1.604 1.00 0.00 H new ATOM 0 HB3 PRO A 31 28.074 12.259 1.960 1.00 0.00 H new ATOM 0 HG2 PRO A 31 29.093 9.864 2.572 1.00 0.00 H new ATOM 0 HG3 PRO A 31 27.442 10.007 2.005 1.00 0.00 H new ATOM 0 HD2 PRO A 31 29.873 9.046 0.517 1.00 0.00 H new ATOM 0 HD3 PRO A 31 28.217 8.485 0.403 1.00 0.00 H new ATOM 492 N VAL A 32 30.367 12.241 -1.504 1.00 0.00 N ATOM 493 CA VAL A 32 31.279 13.136 -2.202 1.00 0.00 C ATOM 494 C VAL A 32 30.847 13.325 -3.656 1.00 0.00 C ATOM 495 O VAL A 32 31.511 14.013 -4.430 1.00 0.00 O ATOM 496 CB VAL A 32 32.738 12.636 -2.148 1.00 0.00 C ATOM 497 CG1 VAL A 32 33.234 12.596 -0.710 1.00 0.00 C ATOM 498 CG2 VAL A 32 32.869 11.270 -2.799 1.00 0.00 C ATOM 0 H VAL A 32 30.560 11.248 -1.633 1.00 0.00 H new ATOM 0 HA VAL A 32 31.236 14.096 -1.687 1.00 0.00 H new ATOM 0 HB VAL A 32 33.358 13.336 -2.708 1.00 0.00 H new ATOM 0 HG11 VAL A 32 34.264 12.241 -0.690 1.00 0.00 H new ATOM 0 HG12 VAL A 32 33.187 13.597 -0.281 1.00 0.00 H new ATOM 0 HG13 VAL A 32 32.607 11.921 -0.127 1.00 0.00 H new ATOM 0 HG21 VAL A 32 33.907 10.940 -2.748 1.00 0.00 H new ATOM 0 HG22 VAL A 32 32.235 10.555 -2.275 1.00 0.00 H new ATOM 0 HG23 VAL A 32 32.560 11.333 -3.842 1.00 0.00 H new ATOM 508 N ASP A 33 29.728 12.706 -4.017 1.00 0.00 N ATOM 509 CA ASP A 33 29.153 12.859 -5.348 1.00 0.00 C ATOM 510 C ASP A 33 28.014 13.864 -5.307 1.00 0.00 C ATOM 511 O ASP A 33 27.235 13.887 -4.355 1.00 0.00 O ATOM 512 CB ASP A 33 28.608 11.526 -5.888 1.00 0.00 C ATOM 513 CG ASP A 33 29.678 10.489 -6.154 1.00 0.00 C ATOM 514 OD1 ASP A 33 30.415 10.626 -7.153 1.00 0.00 O ATOM 515 OD2 ASP A 33 29.763 9.505 -5.389 1.00 0.00 O ATOM 0 H ASP A 33 29.198 12.089 -3.401 1.00 0.00 H new ATOM 0 HA ASP A 33 29.948 13.207 -6.008 1.00 0.00 H new ATOM 0 HB2 ASP A 33 27.893 11.121 -5.172 1.00 0.00 H new ATOM 0 HB3 ASP A 33 28.062 11.716 -6.812 1.00 0.00 H new ATOM 520 N ASP A 34 27.919 14.694 -6.331 1.00 0.00 N ATOM 521 CA ASP A 34 26.818 15.640 -6.435 1.00 0.00 C ATOM 522 C ASP A 34 25.603 14.957 -7.038 1.00 0.00 C ATOM 523 O ASP A 34 25.599 14.597 -8.220 1.00 0.00 O ATOM 524 CB ASP A 34 27.211 16.849 -7.284 1.00 0.00 C ATOM 525 CG ASP A 34 28.313 17.671 -6.656 1.00 0.00 C ATOM 526 OD1 ASP A 34 28.021 18.470 -5.744 1.00 0.00 O ATOM 527 OD2 ASP A 34 29.480 17.528 -7.084 1.00 0.00 O ATOM 0 H ASP A 34 28.587 14.734 -7.100 1.00 0.00 H new ATOM 0 HA ASP A 34 26.575 15.992 -5.432 1.00 0.00 H new ATOM 0 HB2 ASP A 34 27.534 16.507 -8.267 1.00 0.00 H new ATOM 0 HB3 ASP A 34 26.335 17.480 -7.437 1.00 0.00 H new ATOM 532 N TYR A 35 24.574 14.770 -6.231 1.00 0.00 N ATOM 533 CA TYR A 35 23.394 14.050 -6.674 1.00 0.00 C ATOM 534 C TYR A 35 22.128 14.729 -6.176 1.00 0.00 C ATOM 535 O TYR A 35 22.152 15.475 -5.201 1.00 0.00 O ATOM 536 CB TYR A 35 23.433 12.606 -6.168 1.00 0.00 C ATOM 537 CG TYR A 35 23.181 12.469 -4.678 1.00 0.00 C ATOM 538 CD1 TYR A 35 24.211 12.607 -3.753 1.00 0.00 C ATOM 539 CD2 TYR A 35 21.905 12.196 -4.201 1.00 0.00 C ATOM 540 CE1 TYR A 35 23.973 12.475 -2.397 1.00 0.00 C ATOM 541 CE2 TYR A 35 21.661 12.061 -2.851 1.00 0.00 C ATOM 542 CZ TYR A 35 22.697 12.203 -1.952 1.00 0.00 C ATOM 543 OH TYR A 35 22.454 12.052 -0.606 1.00 0.00 O ATOM 0 H TYR A 35 24.531 15.105 -5.269 1.00 0.00 H new ATOM 0 HA TYR A 35 23.387 14.051 -7.764 1.00 0.00 H new ATOM 0 HB2 TYR A 35 22.687 12.022 -6.708 1.00 0.00 H new ATOM 0 HB3 TYR A 35 24.406 12.175 -6.403 1.00 0.00 H new ATOM 0 HD1 TYR A 35 25.212 12.820 -4.099 1.00 0.00 H new ATOM 0 HD2 TYR A 35 21.089 12.088 -4.901 1.00 0.00 H new ATOM 0 HE1 TYR A 35 24.783 12.584 -1.691 1.00 0.00 H new ATOM 0 HE2 TYR A 35 20.663 11.845 -2.499 1.00 0.00 H new ATOM 0 HH TYR A 35 21.502 11.865 -0.464 1.00 0.00 H new ATOM 553 N VAL A 36 21.026 14.455 -6.847 1.00 0.00 N ATOM 554 CA VAL A 36 19.729 14.966 -6.443 1.00 0.00 C ATOM 555 C VAL A 36 18.710 13.836 -6.490 1.00 0.00 C ATOM 556 O VAL A 36 18.758 12.992 -7.385 1.00 0.00 O ATOM 557 CB VAL A 36 19.273 16.130 -7.353 1.00 0.00 C ATOM 558 CG1 VAL A 36 17.902 16.646 -6.951 1.00 0.00 C ATOM 559 CG2 VAL A 36 20.284 17.261 -7.318 1.00 0.00 C ATOM 0 H VAL A 36 21.003 13.874 -7.685 1.00 0.00 H new ATOM 0 HA VAL A 36 19.809 15.353 -5.427 1.00 0.00 H new ATOM 0 HB VAL A 36 19.205 15.744 -8.370 1.00 0.00 H new ATOM 0 HG11 VAL A 36 17.613 17.463 -7.611 1.00 0.00 H new ATOM 0 HG12 VAL A 36 17.172 15.840 -7.030 1.00 0.00 H new ATOM 0 HG13 VAL A 36 17.936 17.005 -5.922 1.00 0.00 H new ATOM 0 HG21 VAL A 36 19.946 18.071 -7.964 1.00 0.00 H new ATOM 0 HG22 VAL A 36 20.383 17.629 -6.297 1.00 0.00 H new ATOM 0 HG23 VAL A 36 21.250 16.897 -7.668 1.00 0.00 H new ATOM 569 N ILE A 37 17.814 13.797 -5.517 1.00 0.00 N ATOM 570 CA ILE A 37 16.811 12.747 -5.455 1.00 0.00 C ATOM 571 C ILE A 37 15.469 13.264 -5.953 1.00 0.00 C ATOM 572 O ILE A 37 14.924 14.230 -5.406 1.00 0.00 O ATOM 573 CB ILE A 37 16.646 12.198 -4.024 1.00 0.00 C ATOM 574 CG1 ILE A 37 18.004 11.805 -3.440 1.00 0.00 C ATOM 575 CG2 ILE A 37 15.705 11.002 -4.020 1.00 0.00 C ATOM 576 CD1 ILE A 37 17.927 11.318 -2.010 1.00 0.00 C ATOM 0 H ILE A 37 17.761 14.479 -4.761 1.00 0.00 H new ATOM 0 HA ILE A 37 17.154 11.936 -6.097 1.00 0.00 H new ATOM 0 HB ILE A 37 16.216 12.983 -3.402 1.00 0.00 H new ATOM 0 HG12 ILE A 37 18.444 11.023 -4.059 1.00 0.00 H new ATOM 0 HG13 ILE A 37 18.673 12.664 -3.488 1.00 0.00 H new ATOM 0 HG21 ILE A 37 15.599 10.626 -3.002 1.00 0.00 H new ATOM 0 HG22 ILE A 37 14.729 11.306 -4.398 1.00 0.00 H new ATOM 0 HG23 ILE A 37 16.112 10.216 -4.657 1.00 0.00 H new ATOM 0 HD11 ILE A 37 18.926 11.057 -1.660 1.00 0.00 H new ATOM 0 HD12 ILE A 37 17.516 12.106 -1.379 1.00 0.00 H new ATOM 0 HD13 ILE A 37 17.283 10.440 -1.959 1.00 0.00 H new ATOM 588 N ASP A 38 14.940 12.623 -6.989 1.00 0.00 N ATOM 589 CA ASP A 38 13.647 13.013 -7.546 1.00 0.00 C ATOM 590 C ASP A 38 12.570 12.038 -7.095 1.00 0.00 C ATOM 591 O ASP A 38 12.340 11.002 -7.719 1.00 0.00 O ATOM 592 CB ASP A 38 13.691 13.092 -9.081 1.00 0.00 C ATOM 593 CG ASP A 38 12.350 13.487 -9.689 1.00 0.00 C ATOM 594 OD1 ASP A 38 11.600 14.243 -9.043 1.00 0.00 O ATOM 595 OD2 ASP A 38 12.042 13.034 -10.814 1.00 0.00 O ATOM 0 H ASP A 38 15.383 11.834 -7.460 1.00 0.00 H new ATOM 0 HA ASP A 38 13.408 14.009 -7.173 1.00 0.00 H new ATOM 0 HB2 ASP A 38 14.449 13.815 -9.382 1.00 0.00 H new ATOM 0 HB3 ASP A 38 13.996 12.125 -9.482 1.00 0.00 H new ATOM 600 N GLY A 39 11.976 12.338 -5.951 1.00 0.00 N ATOM 601 CA GLY A 39 10.855 11.559 -5.458 1.00 0.00 C ATOM 602 C GLY A 39 11.276 10.365 -4.624 1.00 0.00 C ATOM 603 O GLY A 39 10.525 9.900 -3.772 1.00 0.00 O ATOM 0 H GLY A 39 12.252 13.114 -5.349 1.00 0.00 H new ATOM 0 HA2 GLY A 39 10.210 12.202 -4.860 1.00 0.00 H new ATOM 0 HA3 GLY A 39 10.263 11.212 -6.304 1.00 0.00 H new ATOM 607 N GLY A 40 12.488 9.889 -4.849 1.00 0.00 N ATOM 608 CA GLY A 40 12.945 8.682 -4.195 1.00 0.00 C ATOM 609 C GLY A 40 14.065 8.042 -4.978 1.00 0.00 C ATOM 610 O GLY A 40 14.928 7.367 -4.417 1.00 0.00 O ATOM 0 H GLY A 40 13.168 10.319 -5.476 1.00 0.00 H new ATOM 0 HA2 GLY A 40 13.287 8.916 -3.187 1.00 0.00 H new ATOM 0 HA3 GLY A 40 12.117 7.980 -4.096 1.00 0.00 H new ATOM 614 N GLU A 41 14.050 8.272 -6.282 1.00 0.00 N ATOM 615 CA GLU A 41 15.132 7.837 -7.144 1.00 0.00 C ATOM 616 C GLU A 41 16.269 8.844 -7.095 1.00 0.00 C ATOM 617 O GLU A 41 16.057 10.049 -7.228 1.00 0.00 O ATOM 618 CB GLU A 41 14.639 7.657 -8.582 1.00 0.00 C ATOM 619 CG GLU A 41 13.813 6.398 -8.791 1.00 0.00 C ATOM 620 CD GLU A 41 14.638 5.129 -8.667 1.00 0.00 C ATOM 621 OE1 GLU A 41 15.041 4.781 -7.537 1.00 0.00 O ATOM 622 OE2 GLU A 41 14.888 4.477 -9.701 1.00 0.00 O ATOM 0 H GLU A 41 13.296 8.760 -6.766 1.00 0.00 H new ATOM 0 HA GLU A 41 15.497 6.874 -6.788 1.00 0.00 H new ATOM 0 HB2 GLU A 41 14.041 8.524 -8.863 1.00 0.00 H new ATOM 0 HB3 GLU A 41 15.499 7.632 -9.251 1.00 0.00 H new ATOM 0 HG2 GLU A 41 13.004 6.374 -8.061 1.00 0.00 H new ATOM 0 HG3 GLU A 41 13.351 6.431 -9.778 1.00 0.00 H new ATOM 629 N ILE A 42 17.466 8.337 -6.879 1.00 0.00 N ATOM 630 CA ILE A 42 18.661 9.161 -6.816 1.00 0.00 C ATOM 631 C ILE A 42 19.228 9.340 -8.211 1.00 0.00 C ATOM 632 O ILE A 42 19.245 8.401 -8.994 1.00 0.00 O ATOM 633 CB ILE A 42 19.734 8.503 -5.921 1.00 0.00 C ATOM 634 CG1 ILE A 42 19.189 8.288 -4.512 1.00 0.00 C ATOM 635 CG2 ILE A 42 20.997 9.352 -5.877 1.00 0.00 C ATOM 636 CD1 ILE A 42 20.132 7.530 -3.607 1.00 0.00 C ATOM 0 H ILE A 42 17.640 7.341 -6.742 1.00 0.00 H new ATOM 0 HA ILE A 42 18.389 10.128 -6.392 1.00 0.00 H new ATOM 0 HB ILE A 42 19.990 7.534 -6.350 1.00 0.00 H new ATOM 0 HG12 ILE A 42 18.970 9.257 -4.064 1.00 0.00 H new ATOM 0 HG13 ILE A 42 18.245 7.746 -4.575 1.00 0.00 H new ATOM 0 HG21 ILE A 42 21.738 8.869 -5.241 1.00 0.00 H new ATOM 0 HG22 ILE A 42 21.398 9.460 -6.885 1.00 0.00 H new ATOM 0 HG23 ILE A 42 20.760 10.337 -5.474 1.00 0.00 H new ATOM 0 HD11 ILE A 42 19.678 7.415 -2.623 1.00 0.00 H new ATOM 0 HD12 ILE A 42 20.332 6.546 -4.032 1.00 0.00 H new ATOM 0 HD13 ILE A 42 21.068 8.081 -3.513 1.00 0.00 H new ATOM 648 N ILE A 43 19.657 10.544 -8.544 1.00 0.00 N ATOM 649 CA ILE A 43 20.309 10.772 -9.821 1.00 0.00 C ATOM 650 C ILE A 43 21.499 11.704 -9.643 1.00 0.00 C ATOM 651 O ILE A 43 21.363 12.787 -9.068 1.00 0.00 O ATOM 652 CB ILE A 43 19.363 11.382 -10.889 1.00 0.00 C ATOM 653 CG1 ILE A 43 17.951 10.783 -10.835 1.00 0.00 C ATOM 654 CG2 ILE A 43 19.946 11.165 -12.271 1.00 0.00 C ATOM 655 CD1 ILE A 43 17.023 11.496 -9.874 1.00 0.00 C ATOM 0 H ILE A 43 19.567 11.372 -7.955 1.00 0.00 H new ATOM 0 HA ILE A 43 20.629 9.793 -10.177 1.00 0.00 H new ATOM 0 HB ILE A 43 19.278 12.447 -10.672 1.00 0.00 H new ATOM 0 HG12 ILE A 43 17.516 10.811 -11.834 1.00 0.00 H new ATOM 0 HG13 ILE A 43 18.022 9.734 -10.547 1.00 0.00 H new ATOM 0 HG21 ILE A 43 19.279 11.595 -13.019 1.00 0.00 H new ATOM 0 HG22 ILE A 43 20.921 11.648 -12.334 1.00 0.00 H new ATOM 0 HG23 ILE A 43 20.057 10.096 -12.455 1.00 0.00 H new ATOM 0 HD11 ILE A 43 16.044 11.017 -9.890 1.00 0.00 H new ATOM 0 HD12 ILE A 43 17.435 11.446 -8.866 1.00 0.00 H new ATOM 0 HD13 ILE A 43 16.921 12.539 -10.173 1.00 0.00 H new ATOM 667 N LEU A 44 22.676 11.266 -10.089 1.00 0.00 N ATOM 668 CA LEU A 44 23.842 12.152 -10.153 1.00 0.00 C ATOM 669 C LEU A 44 23.492 13.414 -10.918 1.00 0.00 C ATOM 670 O LEU A 44 22.690 13.373 -11.846 1.00 0.00 O ATOM 671 CB LEU A 44 25.016 11.477 -10.866 1.00 0.00 C ATOM 672 CG LEU A 44 25.518 10.198 -10.219 1.00 0.00 C ATOM 673 CD1 LEU A 44 26.589 9.548 -11.081 1.00 0.00 C ATOM 674 CD2 LEU A 44 26.052 10.480 -8.820 1.00 0.00 C ATOM 0 H LEU A 44 22.849 10.313 -10.409 1.00 0.00 H new ATOM 0 HA LEU A 44 24.129 12.388 -9.128 1.00 0.00 H new ATOM 0 HB2 LEU A 44 24.718 11.254 -11.891 1.00 0.00 H new ATOM 0 HB3 LEU A 44 25.842 12.186 -10.921 1.00 0.00 H new ATOM 0 HG LEU A 44 24.681 9.505 -10.133 1.00 0.00 H new ATOM 0 HD11 LEU A 44 26.937 8.633 -10.601 1.00 0.00 H new ATOM 0 HD12 LEU A 44 26.173 9.309 -12.060 1.00 0.00 H new ATOM 0 HD13 LEU A 44 27.426 10.235 -11.201 1.00 0.00 H new ATOM 0 HD21 LEU A 44 26.407 9.552 -8.372 1.00 0.00 H new ATOM 0 HD22 LEU A 44 26.875 11.192 -8.881 1.00 0.00 H new ATOM 0 HD23 LEU A 44 25.256 10.899 -8.204 1.00 0.00 H new ATOM 686 N ARG A 45 24.116 14.526 -10.560 1.00 0.00 N ATOM 687 CA ARG A 45 23.873 15.785 -11.255 1.00 0.00 C ATOM 688 C ARG A 45 24.293 15.708 -12.719 1.00 0.00 C ATOM 689 O ARG A 45 23.945 16.579 -13.509 1.00 0.00 O ATOM 690 CB ARG A 45 24.600 16.942 -10.574 1.00 0.00 C ATOM 691 CG ARG A 45 23.827 17.565 -9.420 1.00 0.00 C ATOM 692 CD ARG A 45 22.467 18.094 -9.864 1.00 0.00 C ATOM 693 NE ARG A 45 22.517 18.838 -11.126 1.00 0.00 N ATOM 694 CZ ARG A 45 22.984 20.079 -11.258 1.00 0.00 C ATOM 695 NH1 ARG A 45 23.556 20.703 -10.234 1.00 0.00 N ATOM 696 NH2 ARG A 45 22.893 20.689 -12.430 1.00 0.00 N ATOM 0 H ARG A 45 24.791 14.585 -9.797 1.00 0.00 H new ATOM 0 HA ARG A 45 22.799 15.967 -11.211 1.00 0.00 H new ATOM 0 HB2 ARG A 45 25.561 16.586 -10.204 1.00 0.00 H new ATOM 0 HB3 ARG A 45 24.810 17.713 -11.316 1.00 0.00 H new ATOM 0 HG2 ARG A 45 23.688 16.823 -8.634 1.00 0.00 H new ATOM 0 HG3 ARG A 45 24.410 18.379 -8.990 1.00 0.00 H new ATOM 0 HD2 ARG A 45 21.777 17.257 -9.971 1.00 0.00 H new ATOM 0 HD3 ARG A 45 22.065 18.741 -9.085 1.00 0.00 H new ATOM 0 HE ARG A 45 22.169 18.372 -11.964 1.00 0.00 H new ATOM 0 HH11 ARG A 45 23.642 20.232 -9.333 1.00 0.00 H new ATOM 0 HH12 ARG A 45 23.909 21.653 -10.349 1.00 0.00 H new ATOM 0 HH21 ARG A 45 22.468 20.209 -13.223 1.00 0.00 H new ATOM 0 HH22 ARG A 45 23.248 21.639 -12.539 1.00 0.00 H new ATOM 710 N GLU A 46 25.019 14.657 -13.088 1.00 0.00 N ATOM 711 CA GLU A 46 25.459 14.511 -14.471 1.00 0.00 C ATOM 712 C GLU A 46 24.401 13.782 -15.287 1.00 0.00 C ATOM 713 O GLU A 46 24.426 13.796 -16.517 1.00 0.00 O ATOM 714 CB GLU A 46 26.790 13.765 -14.549 1.00 0.00 C ATOM 715 CG GLU A 46 27.920 14.457 -13.803 1.00 0.00 C ATOM 716 CD GLU A 46 29.275 13.859 -14.115 1.00 0.00 C ATOM 717 OE1 GLU A 46 29.554 12.732 -13.656 1.00 0.00 O ATOM 718 OE2 GLU A 46 30.065 14.514 -14.830 1.00 0.00 O ATOM 0 H GLU A 46 25.311 13.907 -12.462 1.00 0.00 H new ATOM 0 HA GLU A 46 25.603 15.508 -14.886 1.00 0.00 H new ATOM 0 HB2 GLU A 46 26.659 12.762 -14.144 1.00 0.00 H new ATOM 0 HB3 GLU A 46 27.073 13.651 -15.596 1.00 0.00 H new ATOM 0 HG2 GLU A 46 27.926 15.516 -14.061 1.00 0.00 H new ATOM 0 HG3 GLU A 46 27.736 14.392 -12.731 1.00 0.00 H new ATOM 725 N ASN A 47 23.468 13.148 -14.593 1.00 0.00 N ATOM 726 CA ASN A 47 22.403 12.402 -15.247 1.00 0.00 C ATOM 727 C ASN A 47 21.044 13.010 -14.917 1.00 0.00 C ATOM 728 O ASN A 47 20.039 12.708 -15.562 1.00 0.00 O ATOM 729 CB ASN A 47 22.436 10.929 -14.814 1.00 0.00 C ATOM 730 CG ASN A 47 23.706 10.216 -15.247 1.00 0.00 C ATOM 731 OD1 ASN A 47 24.303 10.558 -16.266 1.00 0.00 O ATOM 732 ND2 ASN A 47 24.118 9.204 -14.492 1.00 0.00 N ATOM 0 H ASN A 47 23.427 13.135 -13.574 1.00 0.00 H new ATOM 0 HA ASN A 47 22.560 12.456 -16.324 1.00 0.00 H new ATOM 0 HB2 ASN A 47 22.345 10.872 -13.729 1.00 0.00 H new ATOM 0 HB3 ASN A 47 21.573 10.412 -15.234 1.00 0.00 H new ATOM 0 HD21 ASN A 47 24.955 8.682 -14.751 1.00 0.00 H new ATOM 0 HD22 ASN A 47 23.597 8.949 -13.653 1.00 0.00 H new ATOM 739 N LEU A 48 21.033 13.885 -13.913 1.00 0.00 N ATOM 740 CA LEU A 48 19.800 14.475 -13.402 1.00 0.00 C ATOM 741 C LEU A 48 19.124 15.346 -14.446 1.00 0.00 C ATOM 742 O LEU A 48 17.900 15.364 -14.539 1.00 0.00 O ATOM 743 CB LEU A 48 20.078 15.324 -12.163 1.00 0.00 C ATOM 744 CG LEU A 48 18.836 15.963 -11.543 1.00 0.00 C ATOM 745 CD1 LEU A 48 18.020 14.925 -10.787 1.00 0.00 C ATOM 746 CD2 LEU A 48 19.224 17.114 -10.634 1.00 0.00 C ATOM 0 H LEU A 48 21.875 14.203 -13.434 1.00 0.00 H new ATOM 0 HA LEU A 48 19.137 13.649 -13.144 1.00 0.00 H new ATOM 0 HB2 LEU A 48 20.564 14.701 -11.412 1.00 0.00 H new ATOM 0 HB3 LEU A 48 20.783 16.112 -12.428 1.00 0.00 H new ATOM 0 HG LEU A 48 18.216 16.361 -12.347 1.00 0.00 H new ATOM 0 HD11 LEU A 48 17.140 15.400 -10.353 1.00 0.00 H new ATOM 0 HD12 LEU A 48 17.707 14.138 -11.473 1.00 0.00 H new ATOM 0 HD13 LEU A 48 18.628 14.492 -9.992 1.00 0.00 H new ATOM 0 HD21 LEU A 48 18.326 17.556 -10.202 1.00 0.00 H new ATOM 0 HD22 LEU A 48 19.867 16.746 -9.835 1.00 0.00 H new ATOM 0 HD23 LEU A 48 19.758 17.869 -11.211 1.00 0.00 H new ATOM 758 N GLU A 49 19.930 16.069 -15.212 1.00 0.00 N ATOM 759 CA GLU A 49 19.422 16.993 -16.218 1.00 0.00 C ATOM 760 C GLU A 49 18.397 16.303 -17.116 1.00 0.00 C ATOM 761 O GLU A 49 17.273 16.779 -17.286 1.00 0.00 O ATOM 762 CB GLU A 49 20.578 17.534 -17.061 1.00 0.00 C ATOM 763 CG GLU A 49 21.731 18.090 -16.237 1.00 0.00 C ATOM 764 CD GLU A 49 21.305 19.196 -15.292 1.00 0.00 C ATOM 765 OE1 GLU A 49 20.776 20.219 -15.772 1.00 0.00 O ATOM 766 OE2 GLU A 49 21.495 19.044 -14.068 1.00 0.00 O ATOM 0 H GLU A 49 20.948 16.033 -15.155 1.00 0.00 H new ATOM 0 HA GLU A 49 18.931 17.823 -15.709 1.00 0.00 H new ATOM 0 HB2 GLU A 49 20.953 16.736 -17.701 1.00 0.00 H new ATOM 0 HB3 GLU A 49 20.201 18.319 -17.717 1.00 0.00 H new ATOM 0 HG2 GLU A 49 22.182 17.282 -15.661 1.00 0.00 H new ATOM 0 HG3 GLU A 49 22.500 18.470 -16.909 1.00 0.00 H new ATOM 773 N ARG A 50 18.783 15.153 -17.656 1.00 0.00 N ATOM 774 CA ARG A 50 17.911 14.387 -18.533 1.00 0.00 C ATOM 775 C ARG A 50 16.715 13.829 -17.763 1.00 0.00 C ATOM 776 O ARG A 50 15.603 13.782 -18.283 1.00 0.00 O ATOM 777 CB ARG A 50 18.698 13.251 -19.196 1.00 0.00 C ATOM 778 CG ARG A 50 17.869 12.393 -20.140 1.00 0.00 C ATOM 779 CD ARG A 50 17.193 13.229 -21.217 1.00 0.00 C ATOM 780 NE ARG A 50 18.155 13.963 -22.039 1.00 0.00 N ATOM 781 CZ ARG A 50 18.509 13.596 -23.273 1.00 0.00 C ATOM 782 NH1 ARG A 50 18.057 12.461 -23.792 1.00 0.00 N ATOM 783 NH2 ARG A 50 19.334 14.350 -23.982 1.00 0.00 N ATOM 0 H ARG A 50 19.698 14.731 -17.500 1.00 0.00 H new ATOM 0 HA ARG A 50 17.532 15.053 -19.308 1.00 0.00 H new ATOM 0 HB2 ARG A 50 19.535 13.677 -19.749 1.00 0.00 H new ATOM 0 HB3 ARG A 50 19.121 12.614 -18.419 1.00 0.00 H new ATOM 0 HG2 ARG A 50 18.509 11.645 -20.609 1.00 0.00 H new ATOM 0 HG3 ARG A 50 17.112 11.853 -19.571 1.00 0.00 H new ATOM 0 HD2 ARG A 50 16.595 12.579 -21.856 1.00 0.00 H new ATOM 0 HD3 ARG A 50 16.507 13.934 -20.748 1.00 0.00 H new ATOM 0 HE ARG A 50 18.580 14.803 -21.647 1.00 0.00 H new ATOM 0 HH11 ARG A 50 17.435 11.863 -23.248 1.00 0.00 H new ATOM 0 HH12 ARG A 50 18.331 12.187 -24.735 1.00 0.00 H new ATOM 0 HH21 ARG A 50 19.702 15.215 -23.586 1.00 0.00 H new ATOM 0 HH22 ARG A 50 19.602 14.066 -24.924 1.00 0.00 H new ATOM 797 N TYR A 51 16.943 13.437 -16.516 1.00 0.00 N ATOM 798 CA TYR A 51 15.890 12.840 -15.700 1.00 0.00 C ATOM 799 C TYR A 51 14.790 13.864 -15.415 1.00 0.00 C ATOM 800 O TYR A 51 13.602 13.559 -15.526 1.00 0.00 O ATOM 801 CB TYR A 51 16.471 12.305 -14.389 1.00 0.00 C ATOM 802 CG TYR A 51 15.595 11.276 -13.711 1.00 0.00 C ATOM 803 CD1 TYR A 51 15.715 9.929 -14.023 1.00 0.00 C ATOM 804 CD2 TYR A 51 14.654 11.647 -12.759 1.00 0.00 C ATOM 805 CE1 TYR A 51 14.923 8.980 -13.408 1.00 0.00 C ATOM 806 CE2 TYR A 51 13.859 10.702 -12.139 1.00 0.00 C ATOM 807 CZ TYR A 51 13.998 9.371 -12.468 1.00 0.00 C ATOM 808 OH TYR A 51 13.211 8.424 -11.852 1.00 0.00 O ATOM 0 H TYR A 51 17.845 13.521 -16.047 1.00 0.00 H new ATOM 0 HA TYR A 51 15.454 12.008 -16.253 1.00 0.00 H new ATOM 0 HB2 TYR A 51 17.447 11.863 -14.588 1.00 0.00 H new ATOM 0 HB3 TYR A 51 16.632 13.139 -13.706 1.00 0.00 H new ATOM 0 HD1 TYR A 51 16.441 9.618 -14.760 1.00 0.00 H new ATOM 0 HD2 TYR A 51 14.542 12.689 -12.500 1.00 0.00 H new ATOM 0 HE1 TYR A 51 15.029 7.936 -13.664 1.00 0.00 H new ATOM 0 HE2 TYR A 51 13.132 11.005 -11.400 1.00 0.00 H new ATOM 0 HH TYR A 51 12.611 8.863 -11.214 1.00 0.00 H new ATOM 818 N LEU A 52 15.197 15.082 -15.073 1.00 0.00 N ATOM 819 CA LEU A 52 14.256 16.167 -14.802 1.00 0.00 C ATOM 820 C LEU A 52 13.601 16.648 -16.091 1.00 0.00 C ATOM 821 O LEU A 52 12.522 17.230 -16.067 1.00 0.00 O ATOM 822 CB LEU A 52 14.962 17.339 -14.115 1.00 0.00 C ATOM 823 CG LEU A 52 15.548 17.035 -12.735 1.00 0.00 C ATOM 824 CD1 LEU A 52 16.054 18.315 -12.089 1.00 0.00 C ATOM 825 CD2 LEU A 52 14.517 16.355 -11.849 1.00 0.00 C ATOM 0 H LEU A 52 16.178 15.345 -14.976 1.00 0.00 H new ATOM 0 HA LEU A 52 13.485 15.780 -14.136 1.00 0.00 H new ATOM 0 HB2 LEU A 52 15.766 17.687 -14.764 1.00 0.00 H new ATOM 0 HB3 LEU A 52 14.253 18.161 -14.017 1.00 0.00 H new ATOM 0 HG LEU A 52 16.388 16.351 -12.857 1.00 0.00 H new ATOM 0 HD11 LEU A 52 16.469 18.088 -11.107 1.00 0.00 H new ATOM 0 HD12 LEU A 52 16.828 18.758 -12.716 1.00 0.00 H new ATOM 0 HD13 LEU A 52 15.229 19.018 -11.980 1.00 0.00 H new ATOM 0 HD21 LEU A 52 14.956 16.148 -10.873 1.00 0.00 H new ATOM 0 HD22 LEU A 52 13.654 17.009 -11.728 1.00 0.00 H new ATOM 0 HD23 LEU A 52 14.201 15.419 -12.310 1.00 0.00 H new ATOM 837 N ARG A 53 14.254 16.400 -17.213 1.00 0.00 N ATOM 838 CA ARG A 53 13.696 16.785 -18.499 1.00 0.00 C ATOM 839 C ARG A 53 12.631 15.779 -18.920 1.00 0.00 C ATOM 840 O ARG A 53 11.754 16.082 -19.728 1.00 0.00 O ATOM 841 CB ARG A 53 14.782 16.870 -19.573 1.00 0.00 C ATOM 842 CG ARG A 53 14.388 17.752 -20.748 1.00 0.00 C ATOM 843 CD ARG A 53 14.815 17.155 -22.080 1.00 0.00 C ATOM 844 NE ARG A 53 14.084 15.921 -22.377 1.00 0.00 N ATOM 845 CZ ARG A 53 13.013 15.853 -23.171 1.00 0.00 C ATOM 846 NH1 ARG A 53 12.513 16.946 -23.732 1.00 0.00 N ATOM 847 NH2 ARG A 53 12.433 14.683 -23.385 1.00 0.00 N ATOM 0 H ARG A 53 15.162 15.938 -17.261 1.00 0.00 H new ATOM 0 HA ARG A 53 13.247 17.773 -18.393 1.00 0.00 H new ATOM 0 HB2 ARG A 53 15.698 17.257 -19.126 1.00 0.00 H new ATOM 0 HB3 ARG A 53 15.004 15.867 -19.937 1.00 0.00 H new ATOM 0 HG2 ARG A 53 13.308 17.897 -20.746 1.00 0.00 H new ATOM 0 HG3 ARG A 53 14.842 18.736 -20.630 1.00 0.00 H new ATOM 0 HD2 ARG A 53 14.644 17.880 -22.876 1.00 0.00 H new ATOM 0 HD3 ARG A 53 15.885 16.949 -22.061 1.00 0.00 H new ATOM 0 HE ARG A 53 14.415 15.056 -21.949 1.00 0.00 H new ATOM 0 HH11 ARG A 53 12.947 17.853 -23.559 1.00 0.00 H new ATOM 0 HH12 ARG A 53 11.694 16.880 -24.337 1.00 0.00 H new ATOM 0 HH21 ARG A 53 12.805 13.841 -22.945 1.00 0.00 H new ATOM 0 HH22 ARG A 53 11.614 14.623 -23.990 1.00 0.00 H new ATOM 861 N GLU A 54 12.709 14.576 -18.365 1.00 0.00 N ATOM 862 CA GLU A 54 11.733 13.539 -18.661 1.00 0.00 C ATOM 863 C GLU A 54 10.609 13.542 -17.633 1.00 0.00 C ATOM 864 O GLU A 54 9.446 13.746 -17.981 1.00 0.00 O ATOM 865 CB GLU A 54 12.388 12.155 -18.696 1.00 0.00 C ATOM 866 CG GLU A 54 13.469 12.007 -19.754 1.00 0.00 C ATOM 867 CD GLU A 54 12.998 12.392 -21.141 1.00 0.00 C ATOM 868 OE1 GLU A 54 11.836 12.090 -21.491 1.00 0.00 O ATOM 869 OE2 GLU A 54 13.792 12.990 -21.895 1.00 0.00 O ATOM 0 H GLU A 54 13.438 14.296 -17.708 1.00 0.00 H new ATOM 0 HA GLU A 54 11.318 13.756 -19.645 1.00 0.00 H new ATOM 0 HB2 GLU A 54 12.821 11.945 -17.718 1.00 0.00 H new ATOM 0 HB3 GLU A 54 11.617 11.404 -18.872 1.00 0.00 H new ATOM 0 HG2 GLU A 54 14.323 12.627 -19.482 1.00 0.00 H new ATOM 0 HG3 GLU A 54 13.816 10.974 -19.768 1.00 0.00 H new ATOM 876 N GLN A 55 10.956 13.330 -16.363 1.00 0.00 N ATOM 877 CA GLN A 55 9.953 13.181 -15.319 1.00 0.00 C ATOM 878 C GLN A 55 9.635 14.513 -14.658 1.00 0.00 C ATOM 879 O GLN A 55 8.545 15.053 -14.854 1.00 0.00 O ATOM 880 CB GLN A 55 10.428 12.165 -14.270 1.00 0.00 C ATOM 881 CG GLN A 55 9.490 12.018 -13.074 1.00 0.00 C ATOM 882 CD GLN A 55 9.759 10.758 -12.275 1.00 0.00 C ATOM 883 OE1 GLN A 55 9.178 9.707 -12.546 1.00 0.00 O ATOM 884 NE2 GLN A 55 10.641 10.846 -11.299 1.00 0.00 N ATOM 0 H GLN A 55 11.920 13.259 -16.038 1.00 0.00 H new ATOM 0 HA GLN A 55 9.038 12.814 -15.783 1.00 0.00 H new ATOM 0 HB2 GLN A 55 10.544 11.193 -14.748 1.00 0.00 H new ATOM 0 HB3 GLN A 55 11.413 12.463 -13.911 1.00 0.00 H new ATOM 0 HG2 GLN A 55 9.597 12.886 -12.424 1.00 0.00 H new ATOM 0 HG3 GLN A 55 8.458 12.008 -13.425 1.00 0.00 H new ATOM 0 HE21 GLN A 55 11.101 11.736 -11.106 1.00 0.00 H new ATOM 0 HE22 GLN A 55 10.863 10.024 -10.737 1.00 0.00 H new ATOM 893 N LEU A 56 10.607 15.064 -13.929 1.00 0.00 N ATOM 894 CA LEU A 56 10.383 16.264 -13.112 1.00 0.00 C ATOM 895 C LEU A 56 9.053 16.156 -12.348 1.00 0.00 C ATOM 896 O LEU A 56 8.327 17.143 -12.190 1.00 0.00 O ATOM 897 CB LEU A 56 10.374 17.507 -14.008 1.00 0.00 C ATOM 898 CG LEU A 56 10.575 18.838 -13.282 1.00 0.00 C ATOM 899 CD1 LEU A 56 12.006 18.970 -12.787 1.00 0.00 C ATOM 900 CD2 LEU A 56 10.218 20.002 -14.190 1.00 0.00 C ATOM 0 H LEU A 56 11.559 14.700 -13.886 1.00 0.00 H new ATOM 0 HA LEU A 56 11.192 16.350 -12.387 1.00 0.00 H new ATOM 0 HB2 LEU A 56 11.157 17.399 -14.758 1.00 0.00 H new ATOM 0 HB3 LEU A 56 9.424 17.543 -14.542 1.00 0.00 H new ATOM 0 HG LEU A 56 9.910 18.858 -12.418 1.00 0.00 H new ATOM 0 HD11 LEU A 56 12.127 19.924 -12.274 1.00 0.00 H new ATOM 0 HD12 LEU A 56 12.229 18.156 -12.097 1.00 0.00 H new ATOM 0 HD13 LEU A 56 12.690 18.925 -13.635 1.00 0.00 H new ATOM 0 HD21 LEU A 56 10.368 20.940 -13.655 1.00 0.00 H new ATOM 0 HD22 LEU A 56 10.855 19.983 -15.074 1.00 0.00 H new ATOM 0 HD23 LEU A 56 9.174 19.920 -14.493 1.00 0.00 H new ATOM 912 N GLY A 57 8.738 14.956 -11.876 1.00 0.00 N ATOM 913 CA GLY A 57 7.413 14.704 -11.338 1.00 0.00 C ATOM 914 C GLY A 57 7.417 14.096 -9.951 1.00 0.00 C ATOM 915 O GLY A 57 6.354 13.812 -9.402 1.00 0.00 O ATOM 0 H GLY A 57 9.371 14.157 -11.856 1.00 0.00 H new ATOM 0 HA2 GLY A 57 6.859 15.642 -11.311 1.00 0.00 H new ATOM 0 HA3 GLY A 57 6.878 14.037 -12.014 1.00 0.00 H new ATOM 919 N PHE A 58 8.600 13.906 -9.381 1.00 0.00 N ATOM 920 CA PHE A 58 8.735 13.370 -8.026 1.00 0.00 C ATOM 921 C PHE A 58 8.138 11.964 -7.939 1.00 0.00 C ATOM 922 O PHE A 58 8.076 11.231 -8.929 1.00 0.00 O ATOM 923 CB PHE A 58 8.040 14.278 -6.994 1.00 0.00 C ATOM 924 CG PHE A 58 8.101 15.752 -7.301 1.00 0.00 C ATOM 925 CD1 PHE A 58 9.258 16.338 -7.786 1.00 0.00 C ATOM 926 CD2 PHE A 58 6.984 16.548 -7.099 1.00 0.00 C ATOM 927 CE1 PHE A 58 9.298 17.691 -8.061 1.00 0.00 C ATOM 928 CE2 PHE A 58 7.020 17.900 -7.374 1.00 0.00 C ATOM 929 CZ PHE A 58 8.179 18.471 -7.857 1.00 0.00 C ATOM 0 H PHE A 58 9.488 14.116 -9.837 1.00 0.00 H new ATOM 0 HA PHE A 58 9.800 13.328 -7.799 1.00 0.00 H new ATOM 0 HB2 PHE A 58 6.994 13.981 -6.917 1.00 0.00 H new ATOM 0 HB3 PHE A 58 8.493 14.106 -6.018 1.00 0.00 H new ATOM 0 HD1 PHE A 58 10.137 15.732 -7.951 1.00 0.00 H new ATOM 0 HD2 PHE A 58 6.074 16.105 -6.722 1.00 0.00 H new ATOM 0 HE1 PHE A 58 10.206 18.139 -8.436 1.00 0.00 H new ATOM 0 HE2 PHE A 58 6.143 18.509 -7.211 1.00 0.00 H new ATOM 0 HZ PHE A 58 8.210 19.528 -8.075 1.00 0.00 H new ATOM 939 N GLU A 59 7.708 11.594 -6.740 1.00 0.00 N ATOM 940 CA GLU A 59 7.108 10.289 -6.495 1.00 0.00 C ATOM 941 C GLU A 59 5.598 10.421 -6.310 1.00 0.00 C ATOM 942 O GLU A 59 5.131 10.825 -5.245 1.00 0.00 O ATOM 943 CB GLU A 59 7.739 9.668 -5.250 1.00 0.00 C ATOM 944 CG GLU A 59 7.224 8.287 -4.904 1.00 0.00 C ATOM 945 CD GLU A 59 7.588 7.241 -5.932 1.00 0.00 C ATOM 946 OE1 GLU A 59 8.744 6.777 -5.930 1.00 0.00 O ATOM 947 OE2 GLU A 59 6.708 6.850 -6.729 1.00 0.00 O ATOM 0 H GLU A 59 7.765 12.188 -5.912 1.00 0.00 H new ATOM 0 HA GLU A 59 7.292 9.645 -7.355 1.00 0.00 H new ATOM 0 HB2 GLU A 59 8.818 9.613 -5.394 1.00 0.00 H new ATOM 0 HB3 GLU A 59 7.564 10.330 -4.402 1.00 0.00 H new ATOM 0 HG2 GLU A 59 7.624 7.989 -3.935 1.00 0.00 H new ATOM 0 HG3 GLU A 59 6.139 8.326 -4.803 1.00 0.00 H new ATOM 954 N PHE A 60 4.846 10.081 -7.344 1.00 0.00 N ATOM 955 CA PHE A 60 3.389 10.142 -7.295 1.00 0.00 C ATOM 956 C PHE A 60 2.817 8.824 -6.795 1.00 0.00 C ATOM 957 O PHE A 60 2.783 7.837 -7.530 1.00 0.00 O ATOM 958 CB PHE A 60 2.795 10.437 -8.679 1.00 0.00 C ATOM 959 CG PHE A 60 3.022 11.834 -9.185 1.00 0.00 C ATOM 960 CD1 PHE A 60 2.646 12.930 -8.428 1.00 0.00 C ATOM 961 CD2 PHE A 60 3.585 12.048 -10.432 1.00 0.00 C ATOM 962 CE1 PHE A 60 2.828 14.214 -8.903 1.00 0.00 C ATOM 963 CE2 PHE A 60 3.773 13.330 -10.912 1.00 0.00 C ATOM 964 CZ PHE A 60 3.393 14.415 -10.146 1.00 0.00 C ATOM 0 H PHE A 60 5.221 9.757 -8.235 1.00 0.00 H new ATOM 0 HA PHE A 60 3.124 10.949 -6.612 1.00 0.00 H new ATOM 0 HB2 PHE A 60 3.218 9.734 -9.396 1.00 0.00 H new ATOM 0 HB3 PHE A 60 1.722 10.250 -8.644 1.00 0.00 H new ATOM 0 HD1 PHE A 60 2.205 12.779 -7.454 1.00 0.00 H new ATOM 0 HD2 PHE A 60 3.881 11.203 -11.036 1.00 0.00 H new ATOM 0 HE1 PHE A 60 2.528 15.060 -8.302 1.00 0.00 H new ATOM 0 HE2 PHE A 60 4.216 13.484 -11.885 1.00 0.00 H new ATOM 0 HZ PHE A 60 3.538 15.418 -10.519 1.00 0.00 H new ATOM 974 N LYS A 61 2.362 8.793 -5.548 1.00 0.00 N ATOM 975 CA LYS A 61 1.774 7.574 -5.004 1.00 0.00 C ATOM 976 C LYS A 61 0.315 7.792 -4.609 1.00 0.00 C ATOM 977 O LYS A 61 0.008 8.255 -3.509 1.00 0.00 O ATOM 978 CB LYS A 61 2.584 7.049 -3.815 1.00 0.00 C ATOM 979 CG LYS A 61 4.012 6.667 -4.173 1.00 0.00 C ATOM 980 CD LYS A 61 4.633 5.776 -3.113 1.00 0.00 C ATOM 981 CE LYS A 61 6.006 5.277 -3.537 1.00 0.00 C ATOM 982 NZ LYS A 61 5.956 4.545 -4.834 1.00 0.00 N ATOM 0 H LYS A 61 2.387 9.583 -4.904 1.00 0.00 H new ATOM 0 HA LYS A 61 1.802 6.819 -5.790 1.00 0.00 H new ATOM 0 HB2 LYS A 61 2.605 7.811 -3.036 1.00 0.00 H new ATOM 0 HB3 LYS A 61 2.078 6.179 -3.397 1.00 0.00 H new ATOM 0 HG2 LYS A 61 4.022 6.152 -5.134 1.00 0.00 H new ATOM 0 HG3 LYS A 61 4.613 7.569 -4.289 1.00 0.00 H new ATOM 0 HD2 LYS A 61 4.719 6.328 -2.177 1.00 0.00 H new ATOM 0 HD3 LYS A 61 3.979 4.925 -2.923 1.00 0.00 H new ATOM 0 HE2 LYS A 61 6.689 6.122 -3.624 1.00 0.00 H new ATOM 0 HE3 LYS A 61 6.408 4.621 -2.765 1.00 0.00 H new ATOM 0 HZ1 LYS A 61 6.754 3.881 -4.889 1.00 0.00 H new ATOM 0 HZ2 LYS A 61 5.062 4.018 -4.901 1.00 0.00 H new ATOM 0 HZ3 LYS A 61 6.017 5.225 -5.619 1.00 0.00 H new ATOM 996 N ASN A 62 -0.584 7.470 -5.528 1.00 0.00 N ATOM 997 CA ASN A 62 -2.014 7.615 -5.285 1.00 0.00 C ATOM 998 C ASN A 62 -2.548 6.403 -4.538 1.00 0.00 C ATOM 999 O ASN A 62 -3.263 5.573 -5.110 1.00 0.00 O ATOM 1000 CB ASN A 62 -2.784 7.817 -6.598 1.00 0.00 C ATOM 1001 CG ASN A 62 -2.476 9.143 -7.269 1.00 0.00 C ATOM 1002 OD1 ASN A 62 -3.121 10.158 -6.996 1.00 0.00 O ATOM 1003 ND2 ASN A 62 -1.495 9.145 -8.162 1.00 0.00 N ATOM 0 H ASN A 62 -0.349 7.106 -6.451 1.00 0.00 H new ATOM 0 HA ASN A 62 -2.163 8.502 -4.670 1.00 0.00 H new ATOM 0 HB2 ASN A 62 -2.542 7.005 -7.283 1.00 0.00 H new ATOM 0 HB3 ASN A 62 -3.854 7.757 -6.398 1.00 0.00 H new ATOM 0 HD21 ASN A 62 -1.251 10.007 -8.650 1.00 0.00 H new ATOM 0 HD22 ASN A 62 -0.984 8.285 -8.361 1.00 0.00 H new ATOM 1010 N ALA A 63 -2.154 6.301 -3.270 1.00 0.00 N ATOM 1011 CA ALA A 63 -2.587 5.232 -2.377 1.00 0.00 C ATOM 1012 C ALA A 63 -2.223 3.853 -2.920 1.00 0.00 C ATOM 1013 O ALA A 63 -1.148 3.323 -2.641 1.00 0.00 O ATOM 1014 CB ALA A 63 -4.085 5.330 -2.112 1.00 0.00 C ATOM 0 H ALA A 63 -1.518 6.966 -2.830 1.00 0.00 H new ATOM 0 HA ALA A 63 -2.056 5.358 -1.434 1.00 0.00 H new ATOM 0 HB1 ALA A 63 -4.390 4.524 -1.444 1.00 0.00 H new ATOM 0 HB2 ALA A 63 -4.310 6.291 -1.649 1.00 0.00 H new ATOM 0 HB3 ALA A 63 -4.627 5.245 -3.054 1.00 0.00 H new ATOM 1020 N GLN A 64 -3.114 3.296 -3.724 1.00 0.00 N ATOM 1021 CA GLN A 64 -2.959 1.941 -4.232 1.00 0.00 C ATOM 1022 C GLN A 64 -3.659 1.801 -5.579 1.00 0.00 C ATOM 1023 O GLN A 64 -3.917 0.691 -6.046 1.00 0.00 O ATOM 1024 CB GLN A 64 -3.539 0.936 -3.232 1.00 0.00 C ATOM 1025 CG GLN A 64 -5.020 1.146 -2.945 1.00 0.00 C ATOM 1026 CD GLN A 64 -5.579 0.153 -1.943 1.00 0.00 C ATOM 1027 OE1 GLN A 64 -5.022 -1.047 -1.915 1.00 0.00 O flip ATOM 1028 NE2 GLN A 64 -6.518 0.460 -1.203 1.00 0.00 N flip ATOM 0 H GLN A 64 -3.961 3.767 -4.042 1.00 0.00 H new ATOM 0 HA GLN A 64 -1.897 1.735 -4.365 1.00 0.00 H new ATOM 0 HB2 GLN A 64 -3.392 -0.073 -3.617 1.00 0.00 H new ATOM 0 HB3 GLN A 64 -2.983 1.005 -2.297 1.00 0.00 H new ATOM 0 HG2 GLN A 64 -5.171 2.158 -2.568 1.00 0.00 H new ATOM 0 HG3 GLN A 64 -5.579 1.066 -3.877 1.00 0.00 H new ATOM 0 HE21 GLN A 64 -6.922 1.395 -1.253 1.00 0.00 H new ATOM 0 HE22 GLN A 64 -6.890 -0.222 -0.541 1.00 0.00 H new ATOM 1037 N LEU A 65 -3.942 2.936 -6.204 1.00 0.00 N ATOM 1038 CA LEU A 65 -4.702 2.960 -7.444 1.00 0.00 C ATOM 1039 C LEU A 65 -3.901 2.376 -8.603 1.00 0.00 C ATOM 1040 O LEU A 65 -2.871 2.926 -9.002 1.00 0.00 O ATOM 1041 CB LEU A 65 -5.121 4.393 -7.777 1.00 0.00 C ATOM 1042 CG LEU A 65 -6.043 5.054 -6.753 1.00 0.00 C ATOM 1043 CD1 LEU A 65 -6.277 6.511 -7.113 1.00 0.00 C ATOM 1044 CD2 LEU A 65 -7.363 4.305 -6.664 1.00 0.00 C ATOM 0 H LEU A 65 -3.655 3.856 -5.870 1.00 0.00 H new ATOM 0 HA LEU A 65 -5.589 2.344 -7.300 1.00 0.00 H new ATOM 0 HB2 LEU A 65 -4.223 5.002 -7.881 1.00 0.00 H new ATOM 0 HB3 LEU A 65 -5.621 4.393 -8.746 1.00 0.00 H new ATOM 0 HG LEU A 65 -5.561 5.015 -5.776 1.00 0.00 H new ATOM 0 HD11 LEU A 65 -6.936 6.967 -6.374 1.00 0.00 H new ATOM 0 HD12 LEU A 65 -5.324 7.040 -7.126 1.00 0.00 H new ATOM 0 HD13 LEU A 65 -6.739 6.573 -8.098 1.00 0.00 H new ATOM 0 HD21 LEU A 65 -8.007 4.789 -5.930 1.00 0.00 H new ATOM 0 HD22 LEU A 65 -7.852 4.313 -7.638 1.00 0.00 H new ATOM 0 HD23 LEU A 65 -7.177 3.275 -6.360 1.00 0.00 H new ATOM 1056 N GLU A 66 -4.373 1.258 -9.130 1.00 0.00 N ATOM 1057 CA GLU A 66 -3.759 0.658 -10.300 1.00 0.00 C ATOM 1058 C GLU A 66 -4.242 1.361 -11.563 1.00 0.00 C ATOM 1059 O GLU A 66 -5.269 1.007 -12.141 1.00 0.00 O ATOM 1060 CB GLU A 66 -4.051 -0.847 -10.372 1.00 0.00 C ATOM 1061 CG GLU A 66 -3.538 -1.513 -11.645 1.00 0.00 C ATOM 1062 CD GLU A 66 -2.066 -1.247 -11.902 1.00 0.00 C ATOM 1063 OE1 GLU A 66 -1.733 -0.167 -12.437 1.00 0.00 O ATOM 1064 OE2 GLU A 66 -1.231 -2.113 -11.576 1.00 0.00 O ATOM 0 H GLU A 66 -5.178 0.749 -8.766 1.00 0.00 H new ATOM 0 HA GLU A 66 -2.679 0.781 -10.219 1.00 0.00 H new ATOM 0 HB2 GLU A 66 -3.600 -1.337 -9.509 1.00 0.00 H new ATOM 0 HB3 GLU A 66 -5.127 -1.003 -10.300 1.00 0.00 H new ATOM 0 HG2 GLU A 66 -3.701 -2.589 -11.577 1.00 0.00 H new ATOM 0 HG3 GLU A 66 -4.120 -1.156 -12.495 1.00 0.00 H new ATOM 1071 N HIS A 67 -3.517 2.395 -11.948 1.00 0.00 N ATOM 1072 CA HIS A 67 -3.777 3.109 -13.186 1.00 0.00 C ATOM 1073 C HIS A 67 -2.458 3.502 -13.831 1.00 0.00 C ATOM 1074 O HIS A 67 -2.293 4.618 -14.320 1.00 0.00 O ATOM 1075 CB HIS A 67 -4.652 4.348 -12.944 1.00 0.00 C ATOM 1076 CG HIS A 67 -6.101 4.024 -12.755 1.00 0.00 C ATOM 1077 ND1 HIS A 67 -6.879 4.576 -11.762 1.00 0.00 N ATOM 1078 CD2 HIS A 67 -6.918 3.193 -13.446 1.00 0.00 C ATOM 1079 CE1 HIS A 67 -8.105 4.092 -11.846 1.00 0.00 C ATOM 1080 NE2 HIS A 67 -8.156 3.249 -12.859 1.00 0.00 N ATOM 0 H HIS A 67 -2.731 2.764 -11.412 1.00 0.00 H new ATOM 0 HA HIS A 67 -4.325 2.450 -13.859 1.00 0.00 H new ATOM 0 HB2 HIS A 67 -4.287 4.875 -12.062 1.00 0.00 H new ATOM 0 HB3 HIS A 67 -4.547 5.029 -13.789 1.00 0.00 H new ATOM 0 HD2 HIS A 67 -6.644 2.595 -14.303 1.00 0.00 H new ATOM 0 HE1 HIS A 67 -8.928 4.344 -11.194 1.00 0.00 H new ATOM 0 HE2 HIS A 67 -8.979 2.726 -13.156 1.00 0.00 H new ATOM 1089 N HIS A 68 -1.512 2.569 -13.810 1.00 0.00 N ATOM 1090 CA HIS A 68 -0.214 2.787 -14.433 1.00 0.00 C ATOM 1091 C HIS A 68 -0.376 2.828 -15.946 1.00 0.00 C ATOM 1092 O HIS A 68 -0.854 1.864 -16.545 1.00 0.00 O ATOM 1093 CB HIS A 68 0.776 1.686 -14.038 1.00 0.00 C ATOM 1094 CG HIS A 68 1.136 1.683 -12.584 1.00 0.00 C ATOM 1095 ND1 HIS A 68 0.484 0.908 -11.651 1.00 0.00 N ATOM 1096 CD2 HIS A 68 2.092 2.359 -11.903 1.00 0.00 C ATOM 1097 CE1 HIS A 68 1.019 1.105 -10.461 1.00 0.00 C ATOM 1098 NE2 HIS A 68 1.997 1.980 -10.588 1.00 0.00 N ATOM 0 H HIS A 68 -1.621 1.656 -13.368 1.00 0.00 H new ATOM 0 HA HIS A 68 0.184 3.740 -14.084 1.00 0.00 H new ATOM 0 HB2 HIS A 68 0.349 0.717 -14.298 1.00 0.00 H new ATOM 0 HB3 HIS A 68 1.686 1.802 -14.627 1.00 0.00 H new ATOM 0 HD1 HIS A 68 -0.293 0.278 -11.849 1.00 0.00 H new ATOM 0 HD2 HIS A 68 2.797 3.064 -12.318 1.00 0.00 H new ATOM 0 HE1 HIS A 68 0.709 0.631 -9.541 1.00 0.00 H new ATOM 1107 N HIS A 69 0.029 3.950 -16.542 1.00 0.00 N ATOM 1108 CA HIS A 69 -0.140 4.210 -17.975 1.00 0.00 C ATOM 1109 C HIS A 69 -1.601 4.491 -18.307 1.00 0.00 C ATOM 1110 O HIS A 69 -2.512 3.916 -17.715 1.00 0.00 O ATOM 1111 CB HIS A 69 0.371 3.053 -18.846 1.00 0.00 C ATOM 1112 CG HIS A 69 1.829 2.757 -18.678 1.00 0.00 C ATOM 1113 ND1 HIS A 69 2.299 1.599 -18.094 1.00 0.00 N ATOM 1114 CD2 HIS A 69 2.926 3.467 -19.034 1.00 0.00 C ATOM 1115 CE1 HIS A 69 3.618 1.612 -18.097 1.00 0.00 C ATOM 1116 NE2 HIS A 69 4.024 2.733 -18.663 1.00 0.00 N ATOM 0 H HIS A 69 0.487 4.711 -16.041 1.00 0.00 H new ATOM 0 HA HIS A 69 0.462 5.090 -18.202 1.00 0.00 H new ATOM 0 HB2 HIS A 69 -0.200 2.155 -18.610 1.00 0.00 H new ATOM 0 HB3 HIS A 69 0.177 3.288 -19.893 1.00 0.00 H new ATOM 0 HD2 HIS A 69 2.935 4.432 -19.520 1.00 0.00 H new ATOM 0 HE1 HIS A 69 4.258 0.836 -17.703 1.00 0.00 H new ATOM 0 HE2 HIS A 69 4.996 3.009 -18.802 1.00 0.00 H new ATOM 1125 N HIS A 70 -1.817 5.397 -19.247 1.00 0.00 N ATOM 1126 CA HIS A 70 -3.164 5.719 -19.696 1.00 0.00 C ATOM 1127 C HIS A 70 -3.589 4.763 -20.801 1.00 0.00 C ATOM 1128 O HIS A 70 -2.824 3.879 -21.196 1.00 0.00 O ATOM 1129 CB HIS A 70 -3.236 7.159 -20.212 1.00 0.00 C ATOM 1130 CG HIS A 70 -2.963 8.202 -19.175 1.00 0.00 C ATOM 1131 ND1 HIS A 70 -2.246 9.348 -19.437 1.00 0.00 N ATOM 1132 CD2 HIS A 70 -3.330 8.277 -17.875 1.00 0.00 C ATOM 1133 CE1 HIS A 70 -2.180 10.081 -18.342 1.00 0.00 C ATOM 1134 NE2 HIS A 70 -2.830 9.455 -17.381 1.00 0.00 N ATOM 0 H HIS A 70 -1.078 5.923 -19.714 1.00 0.00 H new ATOM 0 HA HIS A 70 -3.839 5.617 -18.846 1.00 0.00 H new ATOM 0 HB2 HIS A 70 -2.520 7.277 -21.025 1.00 0.00 H new ATOM 0 HB3 HIS A 70 -4.227 7.332 -20.632 1.00 0.00 H new ATOM 0 HD2 HIS A 70 -3.908 7.546 -17.329 1.00 0.00 H new ATOM 0 HE1 HIS A 70 -1.678 11.033 -18.249 1.00 0.00 H new ATOM 0 HE2 HIS A 70 -2.943 9.792 -16.425 1.00 0.00 H new ATOM 1143 N HIS A 71 -4.801 4.945 -21.306 1.00 0.00 N ATOM 1144 CA HIS A 71 -5.279 4.151 -22.430 1.00 0.00 C ATOM 1145 C HIS A 71 -4.493 4.508 -23.683 1.00 0.00 C ATOM 1146 O HIS A 71 -4.229 3.649 -24.527 1.00 0.00 O ATOM 1147 CB HIS A 71 -6.772 4.381 -22.669 1.00 0.00 C ATOM 1148 CG HIS A 71 -7.659 3.824 -21.599 1.00 0.00 C ATOM 1149 ND1 HIS A 71 -8.225 4.598 -20.609 1.00 0.00 N ATOM 1150 CD2 HIS A 71 -8.086 2.560 -21.374 1.00 0.00 C ATOM 1151 CE1 HIS A 71 -8.960 3.836 -19.822 1.00 0.00 C ATOM 1152 NE2 HIS A 71 -8.892 2.597 -20.266 1.00 0.00 N ATOM 0 H HIS A 71 -5.469 5.632 -20.957 1.00 0.00 H new ATOM 0 HA HIS A 71 -5.130 3.097 -22.194 1.00 0.00 H new ATOM 0 HB2 HIS A 71 -6.954 5.452 -22.754 1.00 0.00 H new ATOM 0 HB3 HIS A 71 -7.049 3.934 -23.624 1.00 0.00 H new ATOM 0 HD2 HIS A 71 -7.838 1.686 -21.958 1.00 0.00 H new ATOM 0 HE1 HIS A 71 -9.521 4.170 -18.962 1.00 0.00 H new ATOM 0 HE2 HIS A 71 -9.364 1.794 -19.851 1.00 0.00 H new ATOM 1161 N HIS A 72 -4.125 5.785 -23.781 1.00 0.00 N ATOM 1162 CA HIS A 72 -3.310 6.297 -24.878 1.00 0.00 C ATOM 1163 C HIS A 72 -4.058 6.166 -26.196 1.00 0.00 C ATOM 1164 O HIS A 72 -4.949 7.001 -26.453 1.00 0.00 O ATOM 1165 CB HIS A 72 -1.961 5.565 -24.942 1.00 0.00 C ATOM 1166 CG HIS A 72 -0.945 6.222 -25.830 1.00 0.00 C ATOM 1167 ND1 HIS A 72 -0.550 5.701 -27.045 1.00 0.00 N ATOM 1168 CD2 HIS A 72 -0.223 7.353 -25.658 1.00 0.00 C ATOM 1169 CE1 HIS A 72 0.369 6.483 -27.579 1.00 0.00 C ATOM 1170 NE2 HIS A 72 0.585 7.489 -26.758 1.00 0.00 N ATOM 1171 OXT HIS A 72 -3.754 5.239 -26.973 1.00 0.00 O ATOM 0 H HIS A 72 -4.386 6.496 -23.097 1.00 0.00 H new ATOM 0 HA HIS A 72 -3.111 7.353 -24.697 1.00 0.00 H new ATOM 0 HB2 HIS A 72 -1.552 5.491 -23.934 1.00 0.00 H new ATOM 0 HB3 HIS A 72 -2.129 4.547 -25.293 1.00 0.00 H new ATOM 0 HD2 HIS A 72 -0.273 8.023 -24.813 1.00 0.00 H new ATOM 0 HE1 HIS A 72 0.860 6.325 -28.528 1.00 0.00 H new ATOM 0 HE2 HIS A 72 1.248 8.249 -26.915 1.00 0.00 H new TER 1180 HIS A 72 ATOM 1181 N MET B 1 7.853 -35.162 -14.095 1.00 0.00 N ATOM 1182 CA MET B 1 7.869 -33.732 -13.705 1.00 0.00 C ATOM 1183 C MET B 1 7.361 -32.858 -14.850 1.00 0.00 C ATOM 1184 O MET B 1 7.969 -32.793 -15.920 1.00 0.00 O ATOM 1185 CB MET B 1 9.281 -33.283 -13.265 1.00 0.00 C ATOM 1186 CG MET B 1 10.361 -33.410 -14.337 1.00 0.00 C ATOM 1187 SD MET B 1 10.859 -35.118 -14.648 1.00 0.00 S ATOM 1188 CE MET B 1 11.716 -35.514 -13.121 1.00 0.00 C ATOM 0 H1 MET B 1 7.531 -35.738 -13.291 1.00 0.00 H new ATOM 0 H2 MET B 1 7.206 -35.296 -14.898 1.00 0.00 H new ATOM 0 H3 MET B 1 8.811 -35.457 -14.370 1.00 0.00 H new ATOM 0 HA MET B 1 7.201 -33.613 -12.852 1.00 0.00 H new ATOM 0 HB2 MET B 1 9.231 -32.243 -12.942 1.00 0.00 H new ATOM 0 HB3 MET B 1 9.580 -33.872 -12.398 1.00 0.00 H new ATOM 0 HG2 MET B 1 9.996 -32.970 -15.265 1.00 0.00 H new ATOM 0 HG3 MET B 1 11.235 -32.833 -14.033 1.00 0.00 H new ATOM 0 HE1 MET B 1 12.358 -36.380 -13.278 1.00 0.00 H new ATOM 0 HE2 MET B 1 12.324 -34.663 -12.813 1.00 0.00 H new ATOM 0 HE3 MET B 1 10.987 -35.740 -12.343 1.00 0.00 H new ATOM 1200 N VAL B 2 6.221 -32.215 -14.632 1.00 0.00 N ATOM 1201 CA VAL B 2 5.656 -31.293 -15.610 1.00 0.00 C ATOM 1202 C VAL B 2 5.249 -29.991 -14.935 1.00 0.00 C ATOM 1203 O VAL B 2 4.690 -29.094 -15.569 1.00 0.00 O ATOM 1204 CB VAL B 2 4.431 -31.889 -16.345 1.00 0.00 C ATOM 1205 CG1 VAL B 2 4.833 -33.090 -17.190 1.00 0.00 C ATOM 1206 CG2 VAL B 2 3.334 -32.270 -15.361 1.00 0.00 C ATOM 0 H VAL B 2 5.667 -32.316 -13.782 1.00 0.00 H new ATOM 0 HA VAL B 2 6.433 -31.105 -16.351 1.00 0.00 H new ATOM 0 HB VAL B 2 4.038 -31.120 -17.010 1.00 0.00 H new ATOM 0 HG11 VAL B 2 3.954 -33.490 -17.696 1.00 0.00 H new ATOM 0 HG12 VAL B 2 5.570 -32.783 -17.932 1.00 0.00 H new ATOM 0 HG13 VAL B 2 5.263 -33.859 -16.548 1.00 0.00 H new ATOM 0 HG21 VAL B 2 2.486 -32.686 -15.905 1.00 0.00 H new ATOM 0 HG22 VAL B 2 3.715 -33.013 -14.661 1.00 0.00 H new ATOM 0 HG23 VAL B 2 3.014 -31.384 -14.812 1.00 0.00 H new ATOM 1216 N GLU B 3 5.537 -29.892 -13.643 1.00 0.00 N ATOM 1217 CA GLU B 3 5.210 -28.703 -12.873 1.00 0.00 C ATOM 1218 C GLU B 3 6.476 -28.130 -12.253 1.00 0.00 C ATOM 1219 O GLU B 3 7.541 -28.742 -12.323 1.00 0.00 O ATOM 1220 CB GLU B 3 4.201 -29.031 -11.763 1.00 0.00 C ATOM 1221 CG GLU B 3 3.032 -29.891 -12.216 1.00 0.00 C ATOM 1222 CD GLU B 3 3.126 -31.320 -11.710 1.00 0.00 C ATOM 1223 OE1 GLU B 3 3.994 -32.076 -12.192 1.00 0.00 O ATOM 1224 OE2 GLU B 3 2.325 -31.691 -10.823 1.00 0.00 O ATOM 0 H GLU B 3 5.999 -30.626 -13.106 1.00 0.00 H new ATOM 0 HA GLU B 3 4.763 -27.970 -13.545 1.00 0.00 H new ATOM 0 HB2 GLU B 3 4.722 -29.543 -10.954 1.00 0.00 H new ATOM 0 HB3 GLU B 3 3.814 -28.098 -11.353 1.00 0.00 H new ATOM 0 HG2 GLU B 3 2.101 -29.446 -11.865 1.00 0.00 H new ATOM 0 HG3 GLU B 3 2.991 -29.897 -13.305 1.00 0.00 H new ATOM 1231 N ASN B 4 6.363 -26.951 -11.665 1.00 0.00 N ATOM 1232 CA ASN B 4 7.478 -26.347 -10.943 1.00 0.00 C ATOM 1233 C ASN B 4 7.339 -26.621 -9.453 1.00 0.00 C ATOM 1234 O ASN B 4 6.224 -26.851 -8.973 1.00 0.00 O ATOM 1235 CB ASN B 4 7.541 -24.835 -11.188 1.00 0.00 C ATOM 1236 CG ASN B 4 8.122 -24.470 -12.543 1.00 0.00 C ATOM 1237 OD1 ASN B 4 7.918 -25.319 -13.538 1.00 0.00 O flip ATOM 1238 ND2 ASN B 4 8.752 -23.422 -12.695 1.00 0.00 N flip ATOM 0 H ASN B 4 5.511 -26.390 -11.672 1.00 0.00 H new ATOM 0 HA ASN B 4 8.402 -26.792 -11.312 1.00 0.00 H new ATOM 0 HB2 ASN B 4 6.537 -24.419 -11.107 1.00 0.00 H new ATOM 0 HB3 ASN B 4 8.142 -24.372 -10.406 1.00 0.00 H new ATOM 0 HD21 ASN B 4 8.890 -22.791 -11.906 1.00 0.00 H new ATOM 0 HD22 ASN B 4 9.135 -23.186 -13.610 1.00 0.00 H new ATOM 1245 N PRO B 5 8.466 -26.622 -8.712 1.00 0.00 N ATOM 1246 CA PRO B 5 8.476 -26.844 -7.263 1.00 0.00 C ATOM 1247 C PRO B 5 7.359 -26.094 -6.546 1.00 0.00 C ATOM 1248 O PRO B 5 7.341 -24.860 -6.512 1.00 0.00 O ATOM 1249 CB PRO B 5 9.839 -26.307 -6.840 1.00 0.00 C ATOM 1250 CG PRO B 5 10.714 -26.534 -8.022 1.00 0.00 C ATOM 1251 CD PRO B 5 9.831 -26.419 -9.239 1.00 0.00 C ATOM 0 HA PRO B 5 8.314 -27.892 -7.010 1.00 0.00 H new ATOM 0 HB2 PRO B 5 9.786 -25.249 -6.583 1.00 0.00 H new ATOM 0 HB3 PRO B 5 10.216 -26.830 -5.961 1.00 0.00 H new ATOM 0 HG2 PRO B 5 11.518 -25.799 -8.056 1.00 0.00 H new ATOM 0 HG3 PRO B 5 11.182 -27.517 -7.974 1.00 0.00 H new ATOM 0 HD2 PRO B 5 9.934 -25.444 -9.716 1.00 0.00 H new ATOM 0 HD3 PRO B 5 10.085 -27.169 -9.988 1.00 0.00 H new ATOM 1259 N MET B 6 6.430 -26.857 -5.989 1.00 0.00 N ATOM 1260 CA MET B 6 5.236 -26.308 -5.364 1.00 0.00 C ATOM 1261 C MET B 6 5.573 -25.602 -4.059 1.00 0.00 C ATOM 1262 O MET B 6 6.706 -25.677 -3.572 1.00 0.00 O ATOM 1263 CB MET B 6 4.217 -27.422 -5.101 1.00 0.00 C ATOM 1264 CG MET B 6 3.903 -28.271 -6.326 1.00 0.00 C ATOM 1265 SD MET B 6 5.202 -29.470 -6.693 1.00 0.00 S ATOM 1266 CE MET B 6 4.629 -30.119 -8.261 1.00 0.00 C ATOM 0 H MET B 6 6.483 -27.875 -5.958 1.00 0.00 H new ATOM 0 HA MET B 6 4.806 -25.577 -6.049 1.00 0.00 H new ATOM 0 HB2 MET B 6 4.596 -28.069 -4.310 1.00 0.00 H new ATOM 0 HB3 MET B 6 3.293 -26.977 -4.733 1.00 0.00 H new ATOM 0 HG2 MET B 6 2.962 -28.798 -6.167 1.00 0.00 H new ATOM 0 HG3 MET B 6 3.761 -27.619 -7.188 1.00 0.00 H new ATOM 0 HE1 MET B 6 5.486 -30.344 -8.896 1.00 0.00 H new ATOM 0 HE2 MET B 6 4.054 -31.029 -8.090 1.00 0.00 H new ATOM 0 HE3 MET B 6 3.998 -29.379 -8.752 1.00 0.00 H new ATOM 1276 N VAL B 7 4.585 -24.925 -3.493 1.00 0.00 N ATOM 1277 CA VAL B 7 4.774 -24.185 -2.256 1.00 0.00 C ATOM 1278 C VAL B 7 5.011 -25.124 -1.073 1.00 0.00 C ATOM 1279 O VAL B 7 4.178 -25.972 -0.744 1.00 0.00 O ATOM 1280 CB VAL B 7 3.580 -23.245 -1.958 1.00 0.00 C ATOM 1281 CG1 VAL B 7 3.522 -22.119 -2.979 1.00 0.00 C ATOM 1282 CG2 VAL B 7 2.263 -24.010 -1.942 1.00 0.00 C ATOM 0 H VAL B 7 3.640 -24.873 -3.874 1.00 0.00 H new ATOM 0 HA VAL B 7 5.663 -23.570 -2.393 1.00 0.00 H new ATOM 0 HB VAL B 7 3.733 -22.817 -0.967 1.00 0.00 H new ATOM 0 HG11 VAL B 7 2.677 -21.468 -2.755 1.00 0.00 H new ATOM 0 HG12 VAL B 7 4.446 -21.542 -2.937 1.00 0.00 H new ATOM 0 HG13 VAL B 7 3.401 -22.539 -3.978 1.00 0.00 H new ATOM 0 HG21 VAL B 7 1.445 -23.322 -1.730 1.00 0.00 H new ATOM 0 HG22 VAL B 7 2.102 -24.477 -2.914 1.00 0.00 H new ATOM 0 HG23 VAL B 7 2.299 -24.780 -1.171 1.00 0.00 H new ATOM 1292 N ILE B 8 6.180 -24.993 -0.468 1.00 0.00 N ATOM 1293 CA ILE B 8 6.510 -25.752 0.727 1.00 0.00 C ATOM 1294 C ILE B 8 6.923 -24.792 1.845 1.00 0.00 C ATOM 1295 O ILE B 8 7.231 -25.197 2.968 1.00 0.00 O ATOM 1296 CB ILE B 8 7.634 -26.782 0.441 1.00 0.00 C ATOM 1297 CG1 ILE B 8 7.806 -27.756 1.612 1.00 0.00 C ATOM 1298 CG2 ILE B 8 8.946 -26.079 0.139 1.00 0.00 C ATOM 1299 CD1 ILE B 8 6.582 -28.604 1.877 1.00 0.00 C ATOM 0 H ILE B 8 6.919 -24.366 -0.786 1.00 0.00 H new ATOM 0 HA ILE B 8 5.629 -26.309 1.044 1.00 0.00 H new ATOM 0 HB ILE B 8 7.340 -27.357 -0.437 1.00 0.00 H new ATOM 0 HG12 ILE B 8 8.654 -28.410 1.409 1.00 0.00 H new ATOM 0 HG13 ILE B 8 8.048 -27.191 2.512 1.00 0.00 H new ATOM 0 HG21 ILE B 8 9.719 -26.821 -0.058 1.00 0.00 H new ATOM 0 HG22 ILE B 8 8.824 -25.441 -0.736 1.00 0.00 H new ATOM 0 HG23 ILE B 8 9.238 -25.470 0.994 1.00 0.00 H new ATOM 0 HD11 ILE B 8 6.775 -29.269 2.718 1.00 0.00 H new ATOM 0 HD12 ILE B 8 5.736 -27.958 2.112 1.00 0.00 H new ATOM 0 HD13 ILE B 8 6.351 -29.197 0.992 1.00 0.00 H new ATOM 1311 N ASN B 9 6.897 -23.503 1.524 1.00 0.00 N ATOM 1312 CA ASN B 9 7.232 -22.460 2.484 1.00 0.00 C ATOM 1313 C ASN B 9 6.119 -22.320 3.510 1.00 0.00 C ATOM 1314 O ASN B 9 5.028 -22.868 3.332 1.00 0.00 O ATOM 1315 CB ASN B 9 7.448 -21.115 1.782 1.00 0.00 C ATOM 1316 CG ASN B 9 8.583 -21.147 0.774 1.00 0.00 C ATOM 1317 OD1 ASN B 9 9.543 -21.900 0.923 1.00 0.00 O ATOM 1318 ND2 ASN B 9 8.482 -20.324 -0.259 1.00 0.00 N ATOM 0 H ASN B 9 6.645 -23.155 0.599 1.00 0.00 H new ATOM 0 HA ASN B 9 8.158 -22.746 2.983 1.00 0.00 H new ATOM 0 HB2 ASN B 9 6.528 -20.824 1.275 1.00 0.00 H new ATOM 0 HB3 ASN B 9 7.656 -20.350 2.530 1.00 0.00 H new ATOM 0 HD21 ASN B 9 9.217 -20.300 -0.966 1.00 0.00 H new ATOM 0 HD22 ASN B 9 7.669 -19.714 -0.348 1.00 0.00 H new ATOM 1325 N ASN B 10 6.387 -21.590 4.577 1.00 0.00 N ATOM 1326 CA ASN B 10 5.397 -21.395 5.621 1.00 0.00 C ATOM 1327 C ASN B 10 4.781 -20.004 5.524 1.00 0.00 C ATOM 1328 O ASN B 10 5.183 -19.191 4.688 1.00 0.00 O ATOM 1329 CB ASN B 10 6.011 -21.604 7.012 1.00 0.00 C ATOM 1330 CG ASN B 10 7.023 -20.533 7.399 1.00 0.00 C ATOM 1331 OD1 ASN B 10 7.697 -19.951 6.551 1.00 0.00 O ATOM 1332 ND2 ASN B 10 7.140 -20.276 8.694 1.00 0.00 N ATOM 0 H ASN B 10 7.279 -21.124 4.744 1.00 0.00 H new ATOM 0 HA ASN B 10 4.612 -22.138 5.478 1.00 0.00 H new ATOM 0 HB2 ASN B 10 5.212 -21.622 7.754 1.00 0.00 H new ATOM 0 HB3 ASN B 10 6.497 -22.579 7.043 1.00 0.00 H new ATOM 0 HD21 ASN B 10 7.807 -19.575 9.017 1.00 0.00 H new ATOM 0 HD22 ASN B 10 6.563 -20.780 9.368 1.00 0.00 H new ATOM 1339 N TRP B 11 3.806 -19.740 6.374 1.00 0.00 N ATOM 1340 CA TRP B 11 3.148 -18.446 6.409 1.00 0.00 C ATOM 1341 C TRP B 11 3.824 -17.537 7.426 1.00 0.00 C ATOM 1342 O TRP B 11 4.511 -18.007 8.335 1.00 0.00 O ATOM 1343 CB TRP B 11 1.661 -18.617 6.743 1.00 0.00 C ATOM 1344 CG TRP B 11 1.417 -19.451 7.967 1.00 0.00 C ATOM 1345 CD1 TRP B 11 1.294 -19.009 9.251 1.00 0.00 C ATOM 1346 CD2 TRP B 11 1.273 -20.877 8.018 1.00 0.00 C ATOM 1347 NE1 TRP B 11 1.078 -20.069 10.097 1.00 0.00 N ATOM 1348 CE2 TRP B 11 1.064 -21.227 9.364 1.00 0.00 C ATOM 1349 CE3 TRP B 11 1.303 -21.891 7.054 1.00 0.00 C ATOM 1350 CZ2 TRP B 11 0.883 -22.547 9.770 1.00 0.00 C ATOM 1351 CZ3 TRP B 11 1.124 -23.199 7.459 1.00 0.00 C ATOM 1352 CH2 TRP B 11 0.916 -23.518 8.807 1.00 0.00 C ATOM 0 H TRP B 11 3.450 -20.410 7.055 1.00 0.00 H new ATOM 0 HA TRP B 11 3.231 -17.983 5.426 1.00 0.00 H new ATOM 0 HB2 TRP B 11 1.213 -17.634 6.887 1.00 0.00 H new ATOM 0 HB3 TRP B 11 1.156 -19.076 5.893 1.00 0.00 H new ATOM 0 HD1 TRP B 11 1.357 -17.976 9.558 1.00 0.00 H new ATOM 0 HE1 TRP B 11 0.949 -20.005 11.107 1.00 0.00 H new ATOM 0 HE3 TRP B 11 1.463 -21.655 6.012 1.00 0.00 H new ATOM 0 HZ2 TRP B 11 0.722 -22.795 10.809 1.00 0.00 H new ATOM 0 HZ3 TRP B 11 1.145 -23.990 6.724 1.00 0.00 H new ATOM 0 HH2 TRP B 11 0.779 -24.551 9.092 1.00 0.00 H new ATOM 1363 N HIS B 12 3.639 -16.238 7.266 1.00 0.00 N ATOM 1364 CA HIS B 12 4.225 -15.272 8.183 1.00 0.00 C ATOM 1365 C HIS B 12 3.244 -14.937 9.298 1.00 0.00 C ATOM 1366 O HIS B 12 2.067 -15.297 9.229 1.00 0.00 O ATOM 1367 CB HIS B 12 4.652 -13.999 7.443 1.00 0.00 C ATOM 1368 CG HIS B 12 5.817 -14.200 6.517 1.00 0.00 C ATOM 1369 ND1 HIS B 12 7.114 -13.866 6.847 1.00 0.00 N ATOM 1370 CD2 HIS B 12 5.872 -14.704 5.260 1.00 0.00 C ATOM 1371 CE1 HIS B 12 7.912 -14.156 5.837 1.00 0.00 C ATOM 1372 NE2 HIS B 12 7.182 -14.665 4.864 1.00 0.00 N ATOM 0 H HIS B 12 3.089 -15.827 6.512 1.00 0.00 H new ATOM 0 HA HIS B 12 5.116 -15.720 8.624 1.00 0.00 H new ATOM 0 HB2 HIS B 12 3.805 -13.621 6.870 1.00 0.00 H new ATOM 0 HB3 HIS B 12 4.909 -13.233 8.175 1.00 0.00 H new ATOM 0 HD2 HIS B 12 5.038 -15.068 4.679 1.00 0.00 H new ATOM 0 HE1 HIS B 12 8.981 -14.003 5.812 1.00 0.00 H new ATOM 0 HE2 HIS B 12 7.537 -14.979 3.961 1.00 0.00 H new ATOM 1381 N ASP B 13 3.732 -14.240 10.316 1.00 0.00 N ATOM 1382 CA ASP B 13 2.935 -13.946 11.504 1.00 0.00 C ATOM 1383 C ASP B 13 1.892 -12.867 11.218 1.00 0.00 C ATOM 1384 O ASP B 13 0.718 -13.021 11.554 1.00 0.00 O ATOM 1385 CB ASP B 13 3.849 -13.513 12.655 1.00 0.00 C ATOM 1386 CG ASP B 13 3.086 -13.176 13.921 1.00 0.00 C ATOM 1387 OD1 ASP B 13 2.555 -14.103 14.571 1.00 0.00 O ATOM 1388 OD2 ASP B 13 3.037 -11.985 14.288 1.00 0.00 O ATOM 0 H ASP B 13 4.680 -13.865 10.344 1.00 0.00 H new ATOM 0 HA ASP B 13 2.405 -14.854 11.792 1.00 0.00 H new ATOM 0 HB2 ASP B 13 4.560 -14.311 12.867 1.00 0.00 H new ATOM 0 HB3 ASP B 13 4.429 -12.644 12.344 1.00 0.00 H new ATOM 1393 N LYS B 14 2.323 -11.785 10.585 1.00 0.00 N ATOM 1394 CA LYS B 14 1.425 -10.685 10.255 1.00 0.00 C ATOM 1395 C LYS B 14 1.945 -9.910 9.051 1.00 0.00 C ATOM 1396 O LYS B 14 3.153 -9.861 8.806 1.00 0.00 O ATOM 1397 CB LYS B 14 1.251 -9.749 11.459 1.00 0.00 C ATOM 1398 CG LYS B 14 2.561 -9.208 12.014 1.00 0.00 C ATOM 1399 CD LYS B 14 2.332 -8.285 13.203 1.00 0.00 C ATOM 1400 CE LYS B 14 1.665 -9.009 14.363 1.00 0.00 C ATOM 1401 NZ LYS B 14 1.501 -8.120 15.544 1.00 0.00 N ATOM 0 H LYS B 14 3.289 -11.644 10.289 1.00 0.00 H new ATOM 0 HA LYS B 14 0.452 -11.105 10.001 1.00 0.00 H new ATOM 0 HB2 LYS B 14 0.618 -8.911 11.167 1.00 0.00 H new ATOM 0 HB3 LYS B 14 0.726 -10.284 12.250 1.00 0.00 H new ATOM 0 HG2 LYS B 14 3.199 -10.039 12.316 1.00 0.00 H new ATOM 0 HG3 LYS B 14 3.092 -8.667 11.231 1.00 0.00 H new ATOM 0 HD2 LYS B 14 3.286 -7.874 13.532 1.00 0.00 H new ATOM 0 HD3 LYS B 14 1.711 -7.444 12.895 1.00 0.00 H new ATOM 0 HE2 LYS B 14 0.690 -9.380 14.048 1.00 0.00 H new ATOM 0 HE3 LYS B 14 2.262 -9.878 14.641 1.00 0.00 H new ATOM 0 HZ1 LYS B 14 1.043 -8.647 16.315 1.00 0.00 H new ATOM 0 HZ2 LYS B 14 2.434 -7.786 15.860 1.00 0.00 H new ATOM 0 HZ3 LYS B 14 0.911 -7.304 15.285 1.00 0.00 H new ATOM 1415 N LEU B 15 1.033 -9.317 8.295 1.00 0.00 N ATOM 1416 CA LEU B 15 1.397 -8.551 7.113 1.00 0.00 C ATOM 1417 C LEU B 15 1.196 -7.063 7.367 1.00 0.00 C ATOM 1418 O LEU B 15 2.008 -6.238 6.944 1.00 0.00 O ATOM 1419 CB LEU B 15 0.560 -9.004 5.913 1.00 0.00 C ATOM 1420 CG LEU B 15 0.897 -8.321 4.583 1.00 0.00 C ATOM 1421 CD1 LEU B 15 2.323 -8.640 4.160 1.00 0.00 C ATOM 1422 CD2 LEU B 15 -0.090 -8.737 3.503 1.00 0.00 C ATOM 0 H LEU B 15 0.031 -9.352 8.481 1.00 0.00 H new ATOM 0 HA LEU B 15 2.450 -8.726 6.891 1.00 0.00 H new ATOM 0 HB2 LEU B 15 0.683 -10.080 5.791 1.00 0.00 H new ATOM 0 HB3 LEU B 15 -0.492 -8.827 6.137 1.00 0.00 H new ATOM 0 HG LEU B 15 0.817 -7.243 4.723 1.00 0.00 H new ATOM 0 HD11 LEU B 15 2.541 -8.145 3.214 1.00 0.00 H new ATOM 0 HD12 LEU B 15 3.017 -8.286 4.923 1.00 0.00 H new ATOM 0 HD13 LEU B 15 2.435 -9.718 4.040 1.00 0.00 H new ATOM 0 HD21 LEU B 15 0.166 -8.242 2.566 1.00 0.00 H new ATOM 0 HD22 LEU B 15 -0.046 -9.817 3.366 1.00 0.00 H new ATOM 0 HD23 LEU B 15 -1.098 -8.450 3.802 1.00 0.00 H new ATOM 1434 N THR B 16 0.110 -6.744 8.074 1.00 0.00 N ATOM 1435 CA THR B 16 -0.258 -5.369 8.428 1.00 0.00 C ATOM 1436 C THR B 16 -0.337 -4.471 7.193 1.00 0.00 C ATOM 1437 O THR B 16 -0.456 -4.954 6.064 1.00 0.00 O ATOM 1438 CB THR B 16 0.714 -4.751 9.468 1.00 0.00 C ATOM 1439 OG1 THR B 16 2.030 -4.609 8.920 1.00 0.00 O ATOM 1440 CG2 THR B 16 0.778 -5.609 10.724 1.00 0.00 C ATOM 0 H THR B 16 -0.548 -7.441 8.422 1.00 0.00 H new ATOM 0 HA THR B 16 -1.247 -5.427 8.882 1.00 0.00 H new ATOM 0 HB THR B 16 0.332 -3.764 9.728 1.00 0.00 H new ATOM 0 HG1 THR B 16 2.044 -4.963 8.006 1.00 0.00 H new ATOM 0 HG21 THR B 16 1.465 -5.157 11.439 1.00 0.00 H new ATOM 0 HG22 THR B 16 -0.215 -5.678 11.169 1.00 0.00 H new ATOM 0 HG23 THR B 16 1.129 -6.608 10.465 1.00 0.00 H new ATOM 1448 N GLU B 17 -0.306 -3.163 7.412 1.00 0.00 N ATOM 1449 CA GLU B 17 -0.309 -2.205 6.318 1.00 0.00 C ATOM 1450 C GLU B 17 1.077 -2.141 5.682 1.00 0.00 C ATOM 1451 O GLU B 17 1.249 -1.601 4.591 1.00 0.00 O ATOM 1452 CB GLU B 17 -0.732 -0.811 6.800 1.00 0.00 C ATOM 1453 CG GLU B 17 -2.108 -0.756 7.452 1.00 0.00 C ATOM 1454 CD GLU B 17 -2.093 -1.197 8.904 1.00 0.00 C ATOM 1455 OE1 GLU B 17 -1.887 -0.338 9.785 1.00 0.00 O ATOM 1456 OE2 GLU B 17 -2.279 -2.401 9.170 1.00 0.00 O ATOM 0 H GLU B 17 -0.278 -2.742 8.341 1.00 0.00 H new ATOM 0 HA GLU B 17 -1.034 -2.538 5.575 1.00 0.00 H new ATOM 0 HB2 GLU B 17 0.008 -0.447 7.513 1.00 0.00 H new ATOM 0 HB3 GLU B 17 -0.719 -0.128 5.951 1.00 0.00 H new ATOM 0 HG2 GLU B 17 -2.493 0.262 7.391 1.00 0.00 H new ATOM 0 HG3 GLU B 17 -2.795 -1.390 6.892 1.00 0.00 H new ATOM 1463 N THR B 18 2.059 -2.689 6.398 1.00 0.00 N ATOM 1464 CA THR B 18 3.431 -2.805 5.914 1.00 0.00 C ATOM 1465 C THR B 18 4.132 -1.448 5.842 1.00 0.00 C ATOM 1466 O THR B 18 4.886 -1.084 6.745 1.00 0.00 O ATOM 1467 CB THR B 18 3.496 -3.493 4.531 1.00 0.00 C ATOM 1468 OG1 THR B 18 2.667 -4.667 4.519 1.00 0.00 O ATOM 1469 CG2 THR B 18 4.926 -3.884 4.183 1.00 0.00 C ATOM 0 H THR B 18 1.922 -3.067 7.336 1.00 0.00 H new ATOM 0 HA THR B 18 3.954 -3.427 6.640 1.00 0.00 H new ATOM 0 HB THR B 18 3.134 -2.783 3.788 1.00 0.00 H new ATOM 0 HG1 THR B 18 2.588 -5.021 5.429 1.00 0.00 H new ATOM 0 HG21 THR B 18 4.944 -4.366 3.206 1.00 0.00 H new ATOM 0 HG22 THR B 18 5.552 -2.992 4.159 1.00 0.00 H new ATOM 0 HG23 THR B 18 5.308 -4.575 4.935 1.00 0.00 H new ATOM 1477 N ASP B 19 3.870 -0.697 4.785 1.00 0.00 N ATOM 1478 CA ASP B 19 4.577 0.552 4.554 1.00 0.00 C ATOM 1479 C ASP B 19 3.745 1.728 5.045 1.00 0.00 C ATOM 1480 O ASP B 19 2.913 2.270 4.314 1.00 0.00 O ATOM 1481 CB ASP B 19 4.913 0.705 3.068 1.00 0.00 C ATOM 1482 CG ASP B 19 5.933 1.797 2.807 1.00 0.00 C ATOM 1483 OD1 ASP B 19 7.142 1.541 2.993 1.00 0.00 O ATOM 1484 OD2 ASP B 19 5.540 2.906 2.397 1.00 0.00 O ATOM 0 H ASP B 19 3.175 -0.929 4.075 1.00 0.00 H new ATOM 0 HA ASP B 19 5.511 0.537 5.115 1.00 0.00 H new ATOM 0 HB2 ASP B 19 5.295 -0.242 2.687 1.00 0.00 H new ATOM 0 HB3 ASP B 19 4.000 0.926 2.514 1.00 0.00 H new ATOM 1489 N VAL B 20 3.932 2.069 6.311 1.00 0.00 N ATOM 1490 CA VAL B 20 3.221 3.187 6.925 1.00 0.00 C ATOM 1491 C VAL B 20 4.183 4.331 7.231 1.00 0.00 C ATOM 1492 O VAL B 20 5.282 4.111 7.742 1.00 0.00 O ATOM 1493 CB VAL B 20 2.508 2.755 8.226 1.00 0.00 C ATOM 1494 CG1 VAL B 20 1.713 3.906 8.831 1.00 0.00 C ATOM 1495 CG2 VAL B 20 1.602 1.566 7.960 1.00 0.00 C ATOM 0 H VAL B 20 4.574 1.586 6.939 1.00 0.00 H new ATOM 0 HA VAL B 20 2.469 3.526 6.212 1.00 0.00 H new ATOM 0 HB VAL B 20 3.271 2.462 8.947 1.00 0.00 H new ATOM 0 HG11 VAL B 20 1.224 3.569 9.745 1.00 0.00 H new ATOM 0 HG12 VAL B 20 2.386 4.731 9.063 1.00 0.00 H new ATOM 0 HG13 VAL B 20 0.960 4.242 8.119 1.00 0.00 H new ATOM 0 HG21 VAL B 20 1.106 1.272 8.885 1.00 0.00 H new ATOM 0 HG22 VAL B 20 0.852 1.839 7.217 1.00 0.00 H new ATOM 0 HG23 VAL B 20 2.196 0.732 7.586 1.00 0.00 H new ATOM 1505 N GLN B 21 3.763 5.547 6.912 1.00 0.00 N ATOM 1506 CA GLN B 21 4.598 6.729 7.088 1.00 0.00 C ATOM 1507 C GLN B 21 3.774 7.862 7.692 1.00 0.00 C ATOM 1508 O GLN B 21 2.591 7.696 7.969 1.00 0.00 O ATOM 1509 CB GLN B 21 5.138 7.199 5.734 1.00 0.00 C ATOM 1510 CG GLN B 21 5.802 6.116 4.901 1.00 0.00 C ATOM 1511 CD GLN B 21 5.913 6.516 3.444 1.00 0.00 C ATOM 1512 OE1 GLN B 21 4.959 7.314 2.984 1.00 0.00 O flip ATOM 1513 NE2 GLN B 21 6.836 6.115 2.738 1.00 0.00 N flip ATOM 0 H GLN B 21 2.839 5.743 6.526 1.00 0.00 H new ATOM 0 HA GLN B 21 5.424 6.470 7.750 1.00 0.00 H new ATOM 0 HB2 GLN B 21 4.316 7.626 5.160 1.00 0.00 H new ATOM 0 HB3 GLN B 21 5.858 7.999 5.904 1.00 0.00 H new ATOM 0 HG2 GLN B 21 6.796 5.910 5.298 1.00 0.00 H new ATOM 0 HG3 GLN B 21 5.229 5.192 4.982 1.00 0.00 H new ATOM 0 HE21 GLN B 21 7.550 5.502 3.132 1.00 0.00 H new ATOM 0 HE22 GLN B 21 6.888 6.395 1.759 1.00 0.00 H new ATOM 1522 N ILE B 22 4.409 9.006 7.897 1.00 0.00 N ATOM 1523 CA ILE B 22 3.695 10.247 8.163 1.00 0.00 C ATOM 1524 C ILE B 22 4.219 11.325 7.228 1.00 0.00 C ATOM 1525 O ILE B 22 5.416 11.369 6.935 1.00 0.00 O ATOM 1526 CB ILE B 22 3.817 10.729 9.632 1.00 0.00 C ATOM 1527 CG1 ILE B 22 3.099 9.772 10.582 1.00 0.00 C ATOM 1528 CG2 ILE B 22 3.234 12.127 9.788 1.00 0.00 C ATOM 1529 CD1 ILE B 22 2.972 10.320 11.989 1.00 0.00 C ATOM 0 H ILE B 22 5.424 9.101 7.884 1.00 0.00 H new ATOM 0 HA ILE B 22 2.637 10.053 7.990 1.00 0.00 H new ATOM 0 HB ILE B 22 4.877 10.751 9.886 1.00 0.00 H new ATOM 0 HG12 ILE B 22 2.105 9.558 10.190 1.00 0.00 H new ATOM 0 HG13 ILE B 22 3.640 8.826 10.614 1.00 0.00 H new ATOM 0 HG21 ILE B 22 3.329 12.447 10.826 1.00 0.00 H new ATOM 0 HG22 ILE B 22 3.774 12.820 9.143 1.00 0.00 H new ATOM 0 HG23 ILE B 22 2.181 12.116 9.507 1.00 0.00 H new ATOM 0 HD11 ILE B 22 2.453 9.595 12.616 1.00 0.00 H new ATOM 0 HD12 ILE B 22 3.965 10.509 12.397 1.00 0.00 H new ATOM 0 HD13 ILE B 22 2.406 11.251 11.967 1.00 0.00 H new ATOM 1541 N ASP B 23 3.328 12.168 6.741 1.00 0.00 N ATOM 1542 CA ASP B 23 3.700 13.199 5.794 1.00 0.00 C ATOM 1543 C ASP B 23 4.122 14.473 6.527 1.00 0.00 C ATOM 1544 O ASP B 23 4.279 14.481 7.751 1.00 0.00 O ATOM 1545 CB ASP B 23 2.526 13.499 4.865 1.00 0.00 C ATOM 1546 CG ASP B 23 1.511 14.420 5.498 1.00 0.00 C ATOM 1547 OD1 ASP B 23 0.975 14.078 6.574 1.00 0.00 O ATOM 1548 OD2 ASP B 23 1.266 15.500 4.921 1.00 0.00 O ATOM 0 H ASP B 23 2.338 12.158 6.987 1.00 0.00 H new ATOM 0 HA ASP B 23 4.544 12.841 5.204 1.00 0.00 H new ATOM 0 HB2 ASP B 23 2.900 13.951 3.946 1.00 0.00 H new ATOM 0 HB3 ASP B 23 2.040 12.564 4.585 1.00 0.00 H new ATOM 1553 N PHE B 24 4.303 15.537 5.766 1.00 0.00 N ATOM 1554 CA PHE B 24 4.708 16.827 6.298 1.00 0.00 C ATOM 1555 C PHE B 24 3.629 17.420 7.208 1.00 0.00 C ATOM 1556 O PHE B 24 3.935 18.153 8.149 1.00 0.00 O ATOM 1557 CB PHE B 24 5.007 17.783 5.135 1.00 0.00 C ATOM 1558 CG PHE B 24 5.565 19.109 5.562 1.00 0.00 C ATOM 1559 CD1 PHE B 24 6.919 19.256 5.802 1.00 0.00 C ATOM 1560 CD2 PHE B 24 4.734 20.207 5.722 1.00 0.00 C ATOM 1561 CE1 PHE B 24 7.438 20.474 6.198 1.00 0.00 C ATOM 1562 CE2 PHE B 24 5.247 21.427 6.118 1.00 0.00 C ATOM 1563 CZ PHE B 24 6.600 21.561 6.356 1.00 0.00 C ATOM 0 H PHE B 24 4.172 15.531 4.754 1.00 0.00 H new ATOM 0 HA PHE B 24 5.606 16.688 6.901 1.00 0.00 H new ATOM 0 HB2 PHE B 24 5.714 17.304 4.457 1.00 0.00 H new ATOM 0 HB3 PHE B 24 4.089 17.951 4.571 1.00 0.00 H new ATOM 0 HD1 PHE B 24 7.578 18.409 5.679 1.00 0.00 H new ATOM 0 HD2 PHE B 24 3.675 20.108 5.535 1.00 0.00 H new ATOM 0 HE1 PHE B 24 8.497 20.576 6.384 1.00 0.00 H new ATOM 0 HE2 PHE B 24 4.590 22.275 6.241 1.00 0.00 H new ATOM 0 HZ PHE B 24 7.003 22.514 6.665 1.00 0.00 H new ATOM 1573 N TYR B 25 2.370 17.100 6.930 1.00 0.00 N ATOM 1574 CA TYR B 25 1.258 17.683 7.668 1.00 0.00 C ATOM 1575 C TYR B 25 1.208 17.151 9.099 1.00 0.00 C ATOM 1576 O TYR B 25 0.939 17.909 10.035 1.00 0.00 O ATOM 1577 CB TYR B 25 -0.065 17.415 6.945 1.00 0.00 C ATOM 1578 CG TYR B 25 -1.128 18.448 7.229 1.00 0.00 C ATOM 1579 CD1 TYR B 25 -0.798 19.793 7.317 1.00 0.00 C ATOM 1580 CD2 TYR B 25 -2.458 18.088 7.391 1.00 0.00 C ATOM 1581 CE1 TYR B 25 -1.760 20.746 7.570 1.00 0.00 C ATOM 1582 CE2 TYR B 25 -3.431 19.038 7.644 1.00 0.00 C ATOM 1583 CZ TYR B 25 -3.075 20.366 7.730 1.00 0.00 C ATOM 1584 OH TYR B 25 -4.034 21.322 7.981 1.00 0.00 O ATOM 0 H TYR B 25 2.095 16.442 6.201 1.00 0.00 H new ATOM 0 HA TYR B 25 1.413 18.761 7.717 1.00 0.00 H new ATOM 0 HB2 TYR B 25 0.118 17.380 5.871 1.00 0.00 H new ATOM 0 HB3 TYR B 25 -0.437 16.433 7.237 1.00 0.00 H new ATOM 0 HD1 TYR B 25 0.230 20.098 7.185 1.00 0.00 H new ATOM 0 HD2 TYR B 25 -2.739 17.048 7.318 1.00 0.00 H new ATOM 0 HE1 TYR B 25 -1.485 21.788 7.643 1.00 0.00 H new ATOM 0 HE2 TYR B 25 -4.461 18.741 7.773 1.00 0.00 H new ATOM 0 HH TYR B 25 -4.910 20.892 8.067 1.00 0.00 H new ATOM 1594 N GLY B 26 1.472 15.858 9.274 1.00 0.00 N ATOM 1595 CA GLY B 26 1.552 15.304 10.612 1.00 0.00 C ATOM 1596 C GLY B 26 0.390 14.399 10.956 1.00 0.00 C ATOM 1597 O GLY B 26 0.309 13.901 12.079 1.00 0.00 O ATOM 0 H GLY B 26 1.630 15.190 8.519 1.00 0.00 H new ATOM 0 HA2 GLY B 26 2.482 14.743 10.710 1.00 0.00 H new ATOM 0 HA3 GLY B 26 1.594 16.120 11.334 1.00 0.00 H new ATOM 1601 N ASP B 27 -0.509 14.183 10.004 1.00 0.00 N ATOM 1602 CA ASP B 27 -1.609 13.250 10.215 1.00 0.00 C ATOM 1603 C ASP B 27 -1.079 11.831 10.208 1.00 0.00 C ATOM 1604 O ASP B 27 -0.759 11.276 11.261 1.00 0.00 O ATOM 1605 CB ASP B 27 -2.698 13.397 9.152 1.00 0.00 C ATOM 1606 CG ASP B 27 -3.514 14.654 9.318 1.00 0.00 C ATOM 1607 OD1 ASP B 27 -4.261 14.759 10.315 1.00 0.00 O ATOM 1608 OD2 ASP B 27 -3.418 15.542 8.459 1.00 0.00 O ATOM 0 H ASP B 27 -0.500 14.635 9.089 1.00 0.00 H new ATOM 0 HA ASP B 27 -2.058 13.480 11.181 1.00 0.00 H new ATOM 0 HB2 ASP B 27 -2.237 13.397 8.164 1.00 0.00 H new ATOM 0 HB3 ASP B 27 -3.360 12.532 9.195 1.00 0.00 H new ATOM 1613 N GLU B 28 -0.971 11.262 9.007 1.00 0.00 N ATOM 1614 CA GLU B 28 -0.374 9.950 8.806 1.00 0.00 C ATOM 1615 C GLU B 28 -0.566 9.522 7.358 1.00 0.00 C ATOM 1616 O GLU B 28 -1.459 10.020 6.668 1.00 0.00 O ATOM 1617 CB GLU B 28 -0.978 8.905 9.744 1.00 0.00 C ATOM 1618 CG GLU B 28 -0.085 7.697 9.955 1.00 0.00 C ATOM 1619 CD GLU B 28 -0.628 6.750 11.000 1.00 0.00 C ATOM 1620 OE1 GLU B 28 -1.849 6.791 11.265 1.00 0.00 O ATOM 1621 OE2 GLU B 28 0.166 5.985 11.584 1.00 0.00 O ATOM 0 H GLU B 28 -1.297 11.703 8.147 1.00 0.00 H new ATOM 0 HA GLU B 28 0.689 10.022 9.034 1.00 0.00 H new ATOM 0 HB2 GLU B 28 -1.183 9.369 10.709 1.00 0.00 H new ATOM 0 HB3 GLU B 28 -1.935 8.574 9.340 1.00 0.00 H new ATOM 0 HG2 GLU B 28 0.029 7.164 9.011 1.00 0.00 H new ATOM 0 HG3 GLU B 28 0.908 8.032 10.254 1.00 0.00 H new ATOM 1628 N VAL B 29 0.277 8.610 6.903 1.00 0.00 N ATOM 1629 CA VAL B 29 0.243 8.144 5.529 1.00 0.00 C ATOM 1630 C VAL B 29 0.247 6.624 5.481 1.00 0.00 C ATOM 1631 O VAL B 29 1.271 5.989 5.743 1.00 0.00 O ATOM 1632 CB VAL B 29 1.446 8.673 4.725 1.00 0.00 C ATOM 1633 CG1 VAL B 29 1.402 8.160 3.299 1.00 0.00 C ATOM 1634 CG2 VAL B 29 1.478 10.190 4.738 1.00 0.00 C ATOM 0 H VAL B 29 1.001 8.174 7.474 1.00 0.00 H new ATOM 0 HA VAL B 29 -0.675 8.525 5.082 1.00 0.00 H new ATOM 0 HB VAL B 29 2.357 8.306 5.198 1.00 0.00 H new ATOM 0 HG11 VAL B 29 2.260 8.545 2.747 1.00 0.00 H new ATOM 0 HG12 VAL B 29 1.432 7.070 3.303 1.00 0.00 H new ATOM 0 HG13 VAL B 29 0.482 8.496 2.820 1.00 0.00 H new ATOM 0 HG21 VAL B 29 2.336 10.541 4.164 1.00 0.00 H new ATOM 0 HG22 VAL B 29 0.561 10.577 4.293 1.00 0.00 H new ATOM 0 HG23 VAL B 29 1.560 10.543 5.766 1.00 0.00 H new ATOM 1644 N THR B 30 -0.897 6.046 5.172 1.00 0.00 N ATOM 1645 CA THR B 30 -1.007 4.607 5.021 1.00 0.00 C ATOM 1646 C THR B 30 -1.083 4.249 3.537 1.00 0.00 C ATOM 1647 O THR B 30 -1.211 5.141 2.697 1.00 0.00 O ATOM 1648 CB THR B 30 -2.249 4.065 5.764 1.00 0.00 C ATOM 1649 OG1 THR B 30 -3.439 4.669 5.248 1.00 0.00 O ATOM 1650 CG2 THR B 30 -2.145 4.330 7.258 1.00 0.00 C ATOM 0 H THR B 30 -1.769 6.554 5.020 1.00 0.00 H new ATOM 0 HA THR B 30 -0.123 4.145 5.460 1.00 0.00 H new ATOM 0 HB THR B 30 -2.295 2.988 5.604 1.00 0.00 H new ATOM 0 HG1 THR B 30 -3.439 5.626 5.461 1.00 0.00 H new ATOM 0 HG21 THR B 30 -3.031 3.940 7.759 1.00 0.00 H new ATOM 0 HG22 THR B 30 -1.257 3.837 7.654 1.00 0.00 H new ATOM 0 HG23 THR B 30 -2.073 5.403 7.433 1.00 0.00 H new ATOM 1658 N PRO B 31 -1.009 2.951 3.185 1.00 0.00 N ATOM 1659 CA PRO B 31 -1.109 2.499 1.786 1.00 0.00 C ATOM 1660 C PRO B 31 -2.462 2.815 1.139 1.00 0.00 C ATOM 1661 O PRO B 31 -2.690 2.490 -0.024 1.00 0.00 O ATOM 1662 CB PRO B 31 -0.917 0.981 1.881 1.00 0.00 C ATOM 1663 CG PRO B 31 -1.224 0.638 3.297 1.00 0.00 C ATOM 1664 CD PRO B 31 -0.786 1.822 4.104 1.00 0.00 C ATOM 0 HA PRO B 31 -0.376 3.007 1.159 1.00 0.00 H new ATOM 0 HB2 PRO B 31 -1.582 0.456 1.195 1.00 0.00 H new ATOM 0 HB3 PRO B 31 0.102 0.695 1.618 1.00 0.00 H new ATOM 0 HG2 PRO B 31 -2.288 0.445 3.431 1.00 0.00 H new ATOM 0 HG3 PRO B 31 -0.695 -0.264 3.605 1.00 0.00 H new ATOM 0 HD2 PRO B 31 -1.370 1.925 5.019 1.00 0.00 H new ATOM 0 HD3 PRO B 31 0.260 1.744 4.400 1.00 0.00 H new ATOM 1672 N VAL B 32 -3.365 3.430 1.894 1.00 0.00 N ATOM 1673 CA VAL B 32 -4.663 3.813 1.356 1.00 0.00 C ATOM 1674 C VAL B 32 -4.795 5.332 1.304 1.00 0.00 C ATOM 1675 O VAL B 32 -5.861 5.868 0.990 1.00 0.00 O ATOM 1676 CB VAL B 32 -5.826 3.207 2.175 1.00 0.00 C ATOM 1677 CG1 VAL B 32 -5.695 1.694 2.237 1.00 0.00 C ATOM 1678 CG2 VAL B 32 -5.879 3.797 3.577 1.00 0.00 C ATOM 0 H VAL B 32 -3.223 3.673 2.875 1.00 0.00 H new ATOM 0 HA VAL B 32 -4.725 3.414 0.343 1.00 0.00 H new ATOM 0 HB VAL B 32 -6.760 3.458 1.673 1.00 0.00 H new ATOM 0 HG11 VAL B 32 -6.520 1.281 2.817 1.00 0.00 H new ATOM 0 HG12 VAL B 32 -5.720 1.285 1.227 1.00 0.00 H new ATOM 0 HG13 VAL B 32 -4.750 1.430 2.712 1.00 0.00 H new ATOM 0 HG21 VAL B 32 -6.707 3.351 4.128 1.00 0.00 H new ATOM 0 HG22 VAL B 32 -4.943 3.588 4.095 1.00 0.00 H new ATOM 0 HG23 VAL B 32 -6.025 4.875 3.513 1.00 0.00 H new ATOM 1688 N ASP B 33 -3.701 6.020 1.604 1.00 0.00 N ATOM 1689 CA ASP B 33 -3.671 7.475 1.542 1.00 0.00 C ATOM 1690 C ASP B 33 -2.951 7.933 0.286 1.00 0.00 C ATOM 1691 O ASP B 33 -1.935 7.358 -0.101 1.00 0.00 O ATOM 1692 CB ASP B 33 -2.974 8.079 2.770 1.00 0.00 C ATOM 1693 CG ASP B 33 -3.796 7.973 4.038 1.00 0.00 C ATOM 1694 OD1 ASP B 33 -4.863 8.621 4.116 1.00 0.00 O ATOM 1695 OD2 ASP B 33 -3.371 7.255 4.971 1.00 0.00 O ATOM 0 H ASP B 33 -2.821 5.593 1.893 1.00 0.00 H new ATOM 0 HA ASP B 33 -4.704 7.821 1.525 1.00 0.00 H new ATOM 0 HB2 ASP B 33 -2.019 7.576 2.921 1.00 0.00 H new ATOM 0 HB3 ASP B 33 -2.754 9.129 2.575 1.00 0.00 H new ATOM 1700 N ASP B 34 -3.487 8.958 -0.353 1.00 0.00 N ATOM 1701 CA ASP B 34 -2.845 9.551 -1.516 1.00 0.00 C ATOM 1702 C ASP B 34 -1.753 10.491 -1.048 1.00 0.00 C ATOM 1703 O ASP B 34 -2.001 11.353 -0.203 1.00 0.00 O ATOM 1704 CB ASP B 34 -3.851 10.334 -2.368 1.00 0.00 C ATOM 1705 CG ASP B 34 -4.963 9.476 -2.930 1.00 0.00 C ATOM 1706 OD1 ASP B 34 -4.701 8.680 -3.853 1.00 0.00 O ATOM 1707 OD2 ASP B 34 -6.120 9.615 -2.470 1.00 0.00 O ATOM 0 H ASP B 34 -4.367 9.399 -0.086 1.00 0.00 H new ATOM 0 HA ASP B 34 -2.428 8.751 -2.127 1.00 0.00 H new ATOM 0 HB2 ASP B 34 -4.287 11.129 -1.763 1.00 0.00 H new ATOM 0 HB3 ASP B 34 -3.322 10.814 -3.191 1.00 0.00 H new ATOM 1712 N TYR B 35 -0.550 10.332 -1.575 1.00 0.00 N ATOM 1713 CA TYR B 35 0.552 11.188 -1.176 1.00 0.00 C ATOM 1714 C TYR B 35 1.629 11.239 -2.248 1.00 0.00 C ATOM 1715 O TYR B 35 1.718 10.365 -3.109 1.00 0.00 O ATOM 1716 CB TYR B 35 1.149 10.716 0.154 1.00 0.00 C ATOM 1717 CG TYR B 35 1.964 9.443 0.071 1.00 0.00 C ATOM 1718 CD1 TYR B 35 1.354 8.197 -0.020 1.00 0.00 C ATOM 1719 CD2 TYR B 35 3.351 9.492 0.113 1.00 0.00 C ATOM 1720 CE1 TYR B 35 2.107 7.038 -0.069 1.00 0.00 C ATOM 1721 CE2 TYR B 35 4.107 8.341 0.069 1.00 0.00 C ATOM 1722 CZ TYR B 35 3.483 7.116 -0.020 1.00 0.00 C ATOM 1723 OH TYR B 35 4.235 5.964 -0.050 1.00 0.00 O ATOM 0 H TYR B 35 -0.314 9.626 -2.272 1.00 0.00 H new ATOM 0 HA TYR B 35 0.157 12.196 -1.045 1.00 0.00 H new ATOM 0 HB2 TYR B 35 1.781 11.509 0.554 1.00 0.00 H new ATOM 0 HB3 TYR B 35 0.338 10.565 0.866 1.00 0.00 H new ATOM 0 HD1 TYR B 35 0.276 8.133 -0.053 1.00 0.00 H new ATOM 0 HD2 TYR B 35 3.846 10.449 0.181 1.00 0.00 H new ATOM 0 HE1 TYR B 35 1.620 6.077 -0.145 1.00 0.00 H new ATOM 0 HE2 TYR B 35 5.185 8.399 0.104 1.00 0.00 H new ATOM 0 HH TYR B 35 5.187 6.194 -0.009 1.00 0.00 H new ATOM 1733 N VAL B 36 2.443 12.272 -2.190 1.00 0.00 N ATOM 1734 CA VAL B 36 3.526 12.448 -3.135 1.00 0.00 C ATOM 1735 C VAL B 36 4.786 12.833 -2.385 1.00 0.00 C ATOM 1736 O VAL B 36 4.738 13.621 -1.438 1.00 0.00 O ATOM 1737 CB VAL B 36 3.181 13.519 -4.193 1.00 0.00 C ATOM 1738 CG1 VAL B 36 4.375 13.850 -5.080 1.00 0.00 C ATOM 1739 CG2 VAL B 36 2.005 13.065 -5.036 1.00 0.00 C ATOM 0 H VAL B 36 2.373 13.010 -1.490 1.00 0.00 H new ATOM 0 HA VAL B 36 3.686 11.507 -3.662 1.00 0.00 H new ATOM 0 HB VAL B 36 2.909 14.430 -3.661 1.00 0.00 H new ATOM 0 HG11 VAL B 36 4.088 14.607 -5.809 1.00 0.00 H new ATOM 0 HG12 VAL B 36 5.191 14.230 -4.465 1.00 0.00 H new ATOM 0 HG13 VAL B 36 4.702 12.950 -5.601 1.00 0.00 H new ATOM 0 HG21 VAL B 36 1.772 13.829 -5.778 1.00 0.00 H new ATOM 0 HG22 VAL B 36 2.258 12.133 -5.542 1.00 0.00 H new ATOM 0 HG23 VAL B 36 1.138 12.906 -4.395 1.00 0.00 H new ATOM 1749 N ILE B 37 5.899 12.249 -2.782 1.00 0.00 N ATOM 1750 CA ILE B 37 7.158 12.497 -2.106 1.00 0.00 C ATOM 1751 C ILE B 37 8.028 13.442 -2.931 1.00 0.00 C ATOM 1752 O ILE B 37 8.516 13.071 -3.999 1.00 0.00 O ATOM 1753 CB ILE B 37 7.922 11.182 -1.841 1.00 0.00 C ATOM 1754 CG1 ILE B 37 7.030 10.204 -1.075 1.00 0.00 C ATOM 1755 CG2 ILE B 37 9.197 11.451 -1.059 1.00 0.00 C ATOM 1756 CD1 ILE B 37 7.661 8.847 -0.846 1.00 0.00 C ATOM 0 H ILE B 37 5.958 11.601 -3.567 1.00 0.00 H new ATOM 0 HA ILE B 37 6.932 12.961 -1.146 1.00 0.00 H new ATOM 0 HB ILE B 37 8.194 10.740 -2.799 1.00 0.00 H new ATOM 0 HG12 ILE B 37 6.773 10.641 -0.110 1.00 0.00 H new ATOM 0 HG13 ILE B 37 6.098 10.072 -1.624 1.00 0.00 H new ATOM 0 HG21 ILE B 37 9.721 10.511 -0.883 1.00 0.00 H new ATOM 0 HG22 ILE B 37 9.839 12.123 -1.629 1.00 0.00 H new ATOM 0 HG23 ILE B 37 8.947 11.912 -0.103 1.00 0.00 H new ATOM 0 HD11 ILE B 37 6.967 8.211 -0.297 1.00 0.00 H new ATOM 0 HD12 ILE B 37 7.893 8.387 -1.807 1.00 0.00 H new ATOM 0 HD13 ILE B 37 8.579 8.965 -0.269 1.00 0.00 H new ATOM 1768 N ASP B 38 8.205 14.665 -2.436 1.00 0.00 N ATOM 1769 CA ASP B 38 9.017 15.662 -3.129 1.00 0.00 C ATOM 1770 C ASP B 38 10.488 15.435 -2.823 1.00 0.00 C ATOM 1771 O ASP B 38 11.038 15.992 -1.873 1.00 0.00 O ATOM 1772 CB ASP B 38 8.604 17.090 -2.740 1.00 0.00 C ATOM 1773 CG ASP B 38 9.393 18.155 -3.490 1.00 0.00 C ATOM 1774 OD1 ASP B 38 9.748 17.921 -4.660 1.00 0.00 O ATOM 1775 OD2 ASP B 38 9.661 19.233 -2.908 1.00 0.00 O ATOM 0 H ASP B 38 7.798 14.989 -1.559 1.00 0.00 H new ATOM 0 HA ASP B 38 8.852 15.550 -4.201 1.00 0.00 H new ATOM 0 HB2 ASP B 38 7.541 17.223 -2.940 1.00 0.00 H new ATOM 0 HB3 ASP B 38 8.747 17.226 -1.668 1.00 0.00 H new ATOM 1780 N GLY B 39 11.095 14.535 -3.588 1.00 0.00 N ATOM 1781 CA GLY B 39 12.514 14.261 -3.454 1.00 0.00 C ATOM 1782 C GLY B 39 12.866 13.450 -2.217 1.00 0.00 C ATOM 1783 O GLY B 39 13.946 12.873 -2.140 1.00 0.00 O ATOM 0 H GLY B 39 10.624 13.985 -4.306 1.00 0.00 H new ATOM 0 HA2 GLY B 39 12.857 13.725 -4.339 1.00 0.00 H new ATOM 0 HA3 GLY B 39 13.056 15.206 -3.424 1.00 0.00 H new ATOM 1787 N GLY B 40 11.950 13.382 -1.264 1.00 0.00 N ATOM 1788 CA GLY B 40 12.244 12.761 0.011 1.00 0.00 C ATOM 1789 C GLY B 40 11.318 13.269 1.088 1.00 0.00 C ATOM 1790 O GLY B 40 11.107 12.608 2.105 1.00 0.00 O ATOM 0 H GLY B 40 11.002 13.748 -1.351 1.00 0.00 H new ATOM 0 HA2 GLY B 40 12.146 11.679 -0.077 1.00 0.00 H new ATOM 0 HA3 GLY B 40 13.278 12.966 0.289 1.00 0.00 H new ATOM 1794 N GLU B 41 10.763 14.449 0.860 1.00 0.00 N ATOM 1795 CA GLU B 41 9.772 15.009 1.758 1.00 0.00 C ATOM 1796 C GLU B 41 8.405 14.427 1.416 1.00 0.00 C ATOM 1797 O GLU B 41 7.936 14.554 0.286 1.00 0.00 O ATOM 1798 CB GLU B 41 9.746 16.534 1.634 1.00 0.00 C ATOM 1799 CG GLU B 41 9.020 17.227 2.776 1.00 0.00 C ATOM 1800 CD GLU B 41 9.722 17.036 4.104 1.00 0.00 C ATOM 1801 OE1 GLU B 41 10.706 17.758 4.370 1.00 0.00 O ATOM 1802 OE2 GLU B 41 9.307 16.158 4.885 1.00 0.00 O ATOM 0 H GLU B 41 10.985 15.037 0.057 1.00 0.00 H new ATOM 0 HA GLU B 41 10.028 14.755 2.787 1.00 0.00 H new ATOM 0 HB2 GLU B 41 10.770 16.904 1.589 1.00 0.00 H new ATOM 0 HB3 GLU B 41 9.267 16.805 0.693 1.00 0.00 H new ATOM 0 HG2 GLU B 41 8.941 18.292 2.560 1.00 0.00 H new ATOM 0 HG3 GLU B 41 8.004 16.839 2.846 1.00 0.00 H new ATOM 1809 N ILE B 42 7.781 13.773 2.380 1.00 0.00 N ATOM 1810 CA ILE B 42 6.486 13.145 2.164 1.00 0.00 C ATOM 1811 C ILE B 42 5.370 14.131 2.478 1.00 0.00 C ATOM 1812 O ILE B 42 5.381 14.757 3.527 1.00 0.00 O ATOM 1813 CB ILE B 42 6.320 11.892 3.056 1.00 0.00 C ATOM 1814 CG1 ILE B 42 7.483 10.923 2.835 1.00 0.00 C ATOM 1815 CG2 ILE B 42 4.994 11.203 2.765 1.00 0.00 C ATOM 1816 CD1 ILE B 42 7.501 9.758 3.802 1.00 0.00 C ATOM 0 H ILE B 42 8.151 13.662 3.324 1.00 0.00 H new ATOM 0 HA ILE B 42 6.431 12.842 1.118 1.00 0.00 H new ATOM 0 HB ILE B 42 6.324 12.208 4.099 1.00 0.00 H new ATOM 0 HG12 ILE B 42 7.433 10.537 1.817 1.00 0.00 H new ATOM 0 HG13 ILE B 42 8.421 11.470 2.923 1.00 0.00 H new ATOM 0 HG21 ILE B 42 4.894 10.324 3.401 1.00 0.00 H new ATOM 0 HG22 ILE B 42 4.174 11.892 2.966 1.00 0.00 H new ATOM 0 HG23 ILE B 42 4.964 10.899 1.719 1.00 0.00 H new ATOM 0 HD11 ILE B 42 8.354 9.116 3.582 1.00 0.00 H new ATOM 0 HD12 ILE B 42 7.583 10.133 4.822 1.00 0.00 H new ATOM 0 HD13 ILE B 42 6.579 9.185 3.699 1.00 0.00 H new ATOM 1828 N ILE B 43 4.425 14.295 1.563 1.00 0.00 N ATOM 1829 CA ILE B 43 3.279 15.159 1.815 1.00 0.00 C ATOM 1830 C ILE B 43 1.999 14.460 1.385 1.00 0.00 C ATOM 1831 O ILE B 43 1.966 13.817 0.332 1.00 0.00 O ATOM 1832 CB ILE B 43 3.358 16.515 1.062 1.00 0.00 C ATOM 1833 CG1 ILE B 43 4.769 17.107 1.085 1.00 0.00 C ATOM 1834 CG2 ILE B 43 2.376 17.508 1.667 1.00 0.00 C ATOM 1835 CD1 ILE B 43 5.633 16.663 -0.076 1.00 0.00 C ATOM 0 H ILE B 43 4.428 13.846 0.647 1.00 0.00 H new ATOM 0 HA ILE B 43 3.284 15.363 2.886 1.00 0.00 H new ATOM 0 HB ILE B 43 3.096 16.322 0.022 1.00 0.00 H new ATOM 0 HG12 ILE B 43 4.697 18.195 1.078 1.00 0.00 H new ATOM 0 HG13 ILE B 43 5.257 16.825 2.018 1.00 0.00 H new ATOM 0 HG21 ILE B 43 2.440 18.455 1.131 1.00 0.00 H new ATOM 0 HG22 ILE B 43 1.363 17.113 1.586 1.00 0.00 H new ATOM 0 HG23 ILE B 43 2.621 17.668 2.717 1.00 0.00 H new ATOM 0 HD11 ILE B 43 6.618 17.122 0.007 1.00 0.00 H new ATOM 0 HD12 ILE B 43 5.736 15.578 -0.059 1.00 0.00 H new ATOM 0 HD13 ILE B 43 5.168 16.969 -1.013 1.00 0.00 H new ATOM 1847 N LEU B 44 0.959 14.560 2.211 1.00 0.00 N ATOM 1848 CA LEU B 44 -0.368 14.109 1.811 1.00 0.00 C ATOM 1849 C LEU B 44 -0.774 14.803 0.532 1.00 0.00 C ATOM 1850 O LEU B 44 -0.449 15.968 0.327 1.00 0.00 O ATOM 1851 CB LEU B 44 -1.411 14.418 2.881 1.00 0.00 C ATOM 1852 CG LEU B 44 -1.407 13.492 4.081 1.00 0.00 C ATOM 1853 CD1 LEU B 44 -2.419 13.952 5.121 1.00 0.00 C ATOM 1854 CD2 LEU B 44 -1.689 12.059 3.656 1.00 0.00 C ATOM 0 H LEU B 44 1.011 14.946 3.154 1.00 0.00 H new ATOM 0 HA LEU B 44 -0.322 13.029 1.668 1.00 0.00 H new ATOM 0 HB2 LEU B 44 -1.256 15.439 3.231 1.00 0.00 H new ATOM 0 HB3 LEU B 44 -2.399 14.385 2.421 1.00 0.00 H new ATOM 0 HG LEU B 44 -0.415 13.526 4.532 1.00 0.00 H new ATOM 0 HD11 LEU B 44 -2.399 13.273 5.973 1.00 0.00 H new ATOM 0 HD12 LEU B 44 -2.167 14.959 5.453 1.00 0.00 H new ATOM 0 HD13 LEU B 44 -3.417 13.954 4.682 1.00 0.00 H new ATOM 0 HD21 LEU B 44 -1.681 11.411 4.533 1.00 0.00 H new ATOM 0 HD22 LEU B 44 -2.666 12.008 3.175 1.00 0.00 H new ATOM 0 HD23 LEU B 44 -0.922 11.730 2.955 1.00 0.00 H new ATOM 1866 N ARG B 45 -1.510 14.110 -0.311 1.00 0.00 N ATOM 1867 CA ARG B 45 -1.957 14.690 -1.559 1.00 0.00 C ATOM 1868 C ARG B 45 -2.996 15.774 -1.283 1.00 0.00 C ATOM 1869 O ARG B 45 -3.315 16.578 -2.159 1.00 0.00 O ATOM 1870 CB ARG B 45 -2.519 13.604 -2.476 1.00 0.00 C ATOM 1871 CG ARG B 45 -1.908 13.610 -3.869 1.00 0.00 C ATOM 1872 CD ARG B 45 -2.381 14.797 -4.688 1.00 0.00 C ATOM 1873 NE ARG B 45 -3.824 14.745 -4.922 1.00 0.00 N ATOM 1874 CZ ARG B 45 -4.502 15.626 -5.654 1.00 0.00 C ATOM 1875 NH1 ARG B 45 -3.888 16.678 -6.178 1.00 0.00 N ATOM 1876 NH2 ARG B 45 -5.804 15.451 -5.853 1.00 0.00 N ATOM 0 H ARG B 45 -1.810 13.148 -0.156 1.00 0.00 H new ATOM 0 HA ARG B 45 -1.110 15.150 -2.067 1.00 0.00 H new ATOM 0 HB2 ARG B 45 -2.350 12.629 -2.018 1.00 0.00 H new ATOM 0 HB3 ARG B 45 -3.598 13.734 -2.561 1.00 0.00 H new ATOM 0 HG2 ARG B 45 -0.821 13.634 -3.789 1.00 0.00 H new ATOM 0 HG3 ARG B 45 -2.169 12.686 -4.384 1.00 0.00 H new ATOM 0 HD2 ARG B 45 -2.128 15.722 -4.170 1.00 0.00 H new ATOM 0 HD3 ARG B 45 -1.857 14.813 -5.643 1.00 0.00 H new ATOM 0 HE ARG B 45 -4.347 13.981 -4.495 1.00 0.00 H new ATOM 0 HH11 ARG B 45 -2.890 16.816 -6.021 1.00 0.00 H new ATOM 0 HH12 ARG B 45 -4.414 17.349 -6.738 1.00 0.00 H new ATOM 0 HH21 ARG B 45 -6.278 14.645 -5.446 1.00 0.00 H new ATOM 0 HH22 ARG B 45 -6.329 16.123 -6.413 1.00 0.00 H new ATOM 1890 N GLU B 46 -3.491 15.822 -0.046 1.00 0.00 N ATOM 1891 CA GLU B 46 -4.461 16.843 0.338 1.00 0.00 C ATOM 1892 C GLU B 46 -3.759 18.112 0.823 1.00 0.00 C ATOM 1893 O GLU B 46 -4.388 19.158 0.991 1.00 0.00 O ATOM 1894 CB GLU B 46 -5.443 16.328 1.405 1.00 0.00 C ATOM 1895 CG GLU B 46 -4.835 15.411 2.456 1.00 0.00 C ATOM 1896 CD GLU B 46 -4.815 13.956 2.024 1.00 0.00 C ATOM 1897 OE1 GLU B 46 -3.860 13.553 1.336 1.00 0.00 O ATOM 1898 OE2 GLU B 46 -5.756 13.211 2.375 1.00 0.00 O ATOM 0 H GLU B 46 -3.239 15.173 0.699 1.00 0.00 H new ATOM 0 HA GLU B 46 -5.040 17.086 -0.553 1.00 0.00 H new ATOM 0 HB2 GLU B 46 -5.890 17.185 1.909 1.00 0.00 H new ATOM 0 HB3 GLU B 46 -6.252 15.795 0.905 1.00 0.00 H new ATOM 0 HG2 GLU B 46 -3.817 15.736 2.670 1.00 0.00 H new ATOM 0 HG3 GLU B 46 -5.401 15.503 3.383 1.00 0.00 H new ATOM 1905 N ASN B 47 -2.452 18.022 1.033 1.00 0.00 N ATOM 1906 CA ASN B 47 -1.660 19.181 1.442 1.00 0.00 C ATOM 1907 C ASN B 47 -0.519 19.404 0.450 1.00 0.00 C ATOM 1908 O ASN B 47 0.275 20.336 0.573 1.00 0.00 O ATOM 1909 CB ASN B 47 -1.100 18.970 2.854 1.00 0.00 C ATOM 1910 CG ASN B 47 -0.510 20.237 3.449 1.00 0.00 C ATOM 1911 OD1 ASN B 47 -0.965 21.343 3.160 1.00 0.00 O ATOM 1912 ND2 ASN B 47 0.507 20.083 4.282 1.00 0.00 N ATOM 0 H ASN B 47 -1.916 17.161 0.928 1.00 0.00 H new ATOM 0 HA ASN B 47 -2.301 20.063 1.451 1.00 0.00 H new ATOM 0 HB2 ASN B 47 -1.895 18.605 3.504 1.00 0.00 H new ATOM 0 HB3 ASN B 47 -0.332 18.197 2.824 1.00 0.00 H new ATOM 0 HD21 ASN B 47 0.943 20.899 4.711 1.00 0.00 H new ATOM 0 HD22 ASN B 47 0.854 19.148 4.495 1.00 0.00 H new ATOM 1919 N LEU B 48 -0.477 18.545 -0.556 1.00 0.00 N ATOM 1920 CA LEU B 48 0.611 18.525 -1.524 1.00 0.00 C ATOM 1921 C LEU B 48 0.616 19.768 -2.401 1.00 0.00 C ATOM 1922 O LEU B 48 1.643 20.432 -2.541 1.00 0.00 O ATOM 1923 CB LEU B 48 0.482 17.299 -2.420 1.00 0.00 C ATOM 1924 CG LEU B 48 1.559 17.179 -3.490 1.00 0.00 C ATOM 1925 CD1 LEU B 48 2.862 16.688 -2.883 1.00 0.00 C ATOM 1926 CD2 LEU B 48 1.094 16.272 -4.614 1.00 0.00 C ATOM 0 H LEU B 48 -1.196 17.841 -0.726 1.00 0.00 H new ATOM 0 HA LEU B 48 1.544 18.495 -0.961 1.00 0.00 H new ATOM 0 HB2 LEU B 48 0.507 16.405 -1.796 1.00 0.00 H new ATOM 0 HB3 LEU B 48 -0.493 17.322 -2.906 1.00 0.00 H new ATOM 0 HG LEU B 48 1.742 18.166 -3.914 1.00 0.00 H new ATOM 0 HD11 LEU B 48 3.619 16.609 -3.663 1.00 0.00 H new ATOM 0 HD12 LEU B 48 3.197 17.393 -2.122 1.00 0.00 H new ATOM 0 HD13 LEU B 48 2.706 15.710 -2.428 1.00 0.00 H new ATOM 0 HD21 LEU B 48 1.876 16.198 -5.369 1.00 0.00 H new ATOM 0 HD22 LEU B 48 0.879 15.280 -4.216 1.00 0.00 H new ATOM 0 HD23 LEU B 48 0.192 16.685 -5.065 1.00 0.00 H new ATOM 1938 N GLU B 49 -0.543 20.061 -2.982 1.00 0.00 N ATOM 1939 CA GLU B 49 -0.689 21.125 -3.973 1.00 0.00 C ATOM 1940 C GLU B 49 -0.024 22.424 -3.530 1.00 0.00 C ATOM 1941 O GLU B 49 0.813 22.981 -4.245 1.00 0.00 O ATOM 1942 CB GLU B 49 -2.172 21.374 -4.248 1.00 0.00 C ATOM 1943 CG GLU B 49 -2.889 20.177 -4.849 1.00 0.00 C ATOM 1944 CD GLU B 49 -2.356 19.805 -6.218 1.00 0.00 C ATOM 1945 OE1 GLU B 49 -2.419 20.655 -7.134 1.00 0.00 O ATOM 1946 OE2 GLU B 49 -1.890 18.660 -6.392 1.00 0.00 O ATOM 0 H GLU B 49 -1.411 19.566 -2.779 1.00 0.00 H new ATOM 0 HA GLU B 49 -0.188 20.794 -4.883 1.00 0.00 H new ATOM 0 HB2 GLU B 49 -2.664 21.651 -3.316 1.00 0.00 H new ATOM 0 HB3 GLU B 49 -2.270 22.223 -4.925 1.00 0.00 H new ATOM 0 HG2 GLU B 49 -2.787 19.323 -4.179 1.00 0.00 H new ATOM 0 HG3 GLU B 49 -3.954 20.397 -4.925 1.00 0.00 H new ATOM 1953 N ARG B 50 -0.387 22.894 -2.347 1.00 0.00 N ATOM 1954 CA ARG B 50 0.105 24.173 -1.859 1.00 0.00 C ATOM 1955 C ARG B 50 1.546 24.055 -1.361 1.00 0.00 C ATOM 1956 O ARG B 50 2.334 24.990 -1.517 1.00 0.00 O ATOM 1957 CB ARG B 50 -0.824 24.716 -0.760 1.00 0.00 C ATOM 1958 CG ARG B 50 -0.584 26.180 -0.414 1.00 0.00 C ATOM 1959 CD ARG B 50 0.463 26.345 0.675 1.00 0.00 C ATOM 1960 NE ARG B 50 1.064 27.675 0.655 1.00 0.00 N ATOM 1961 CZ ARG B 50 1.116 28.498 1.700 1.00 0.00 C ATOM 1962 NH1 ARG B 50 0.540 28.172 2.850 1.00 0.00 N ATOM 1963 NH2 ARG B 50 1.751 29.658 1.588 1.00 0.00 N ATOM 0 H ARG B 50 -1.019 22.411 -1.708 1.00 0.00 H new ATOM 0 HA ARG B 50 0.105 24.882 -2.687 1.00 0.00 H new ATOM 0 HB2 ARG B 50 -1.859 24.594 -1.080 1.00 0.00 H new ATOM 0 HB3 ARG B 50 -0.696 24.115 0.140 1.00 0.00 H new ATOM 0 HG2 ARG B 50 -0.264 26.716 -1.308 1.00 0.00 H new ATOM 0 HG3 ARG B 50 -1.520 26.633 -0.088 1.00 0.00 H new ATOM 0 HD2 ARG B 50 0.005 26.168 1.648 1.00 0.00 H new ATOM 0 HD3 ARG B 50 1.241 25.593 0.547 1.00 0.00 H new ATOM 0 HE ARG B 50 1.473 27.997 -0.222 1.00 0.00 H new ATOM 0 HH11 ARG B 50 0.050 27.282 2.941 1.00 0.00 H new ATOM 0 HH12 ARG B 50 0.587 28.811 3.643 1.00 0.00 H new ATOM 0 HH21 ARG B 50 2.195 29.913 0.706 1.00 0.00 H new ATOM 0 HH22 ARG B 50 1.795 30.294 2.384 1.00 0.00 H new ATOM 1977 N TYR B 51 1.914 22.909 -0.788 1.00 0.00 N ATOM 1978 CA TYR B 51 3.272 22.754 -0.274 1.00 0.00 C ATOM 1979 C TYR B 51 4.279 22.702 -1.416 1.00 0.00 C ATOM 1980 O TYR B 51 5.358 23.285 -1.323 1.00 0.00 O ATOM 1981 CB TYR B 51 3.423 21.518 0.619 1.00 0.00 C ATOM 1982 CG TYR B 51 4.779 21.469 1.294 1.00 0.00 C ATOM 1983 CD1 TYR B 51 5.167 22.473 2.171 1.00 0.00 C ATOM 1984 CD2 TYR B 51 5.679 20.442 1.037 1.00 0.00 C ATOM 1985 CE1 TYR B 51 6.408 22.457 2.774 1.00 0.00 C ATOM 1986 CE2 TYR B 51 6.923 20.415 1.643 1.00 0.00 C ATOM 1987 CZ TYR B 51 7.283 21.429 2.508 1.00 0.00 C ATOM 1988 OH TYR B 51 8.522 21.416 3.110 1.00 0.00 O ATOM 0 H TYR B 51 1.309 22.096 -0.670 1.00 0.00 H new ATOM 0 HA TYR B 51 3.475 23.629 0.344 1.00 0.00 H new ATOM 0 HB2 TYR B 51 2.640 21.521 1.377 1.00 0.00 H new ATOM 0 HB3 TYR B 51 3.283 20.618 0.020 1.00 0.00 H new ATOM 0 HD1 TYR B 51 4.484 23.282 2.385 1.00 0.00 H new ATOM 0 HD2 TYR B 51 5.403 19.652 0.354 1.00 0.00 H new ATOM 0 HE1 TYR B 51 6.691 23.248 3.452 1.00 0.00 H new ATOM 0 HE2 TYR B 51 7.608 19.605 1.440 1.00 0.00 H new ATOM 0 HH TYR B 51 8.426 21.158 4.051 1.00 0.00 H new ATOM 1998 N LEU B 52 3.927 22.015 -2.498 1.00 0.00 N ATOM 1999 CA LEU B 52 4.766 22.008 -3.689 1.00 0.00 C ATOM 2000 C LEU B 52 4.870 23.410 -4.254 1.00 0.00 C ATOM 2001 O LEU B 52 5.931 23.836 -4.693 1.00 0.00 O ATOM 2002 CB LEU B 52 4.216 21.061 -4.758 1.00 0.00 C ATOM 2003 CG LEU B 52 4.455 19.579 -4.495 1.00 0.00 C ATOM 2004 CD1 LEU B 52 3.937 18.751 -5.660 1.00 0.00 C ATOM 2005 CD2 LEU B 52 5.935 19.319 -4.265 1.00 0.00 C ATOM 0 H LEU B 52 3.074 21.461 -2.574 1.00 0.00 H new ATOM 0 HA LEU B 52 5.755 21.653 -3.399 1.00 0.00 H new ATOM 0 HB2 LEU B 52 3.143 21.229 -4.852 1.00 0.00 H new ATOM 0 HB3 LEU B 52 4.665 21.321 -5.717 1.00 0.00 H new ATOM 0 HG LEU B 52 3.912 19.286 -3.596 1.00 0.00 H new ATOM 0 HD11 LEU B 52 4.113 17.694 -5.462 1.00 0.00 H new ATOM 0 HD12 LEU B 52 2.868 18.924 -5.783 1.00 0.00 H new ATOM 0 HD13 LEU B 52 4.458 19.041 -6.572 1.00 0.00 H new ATOM 0 HD21 LEU B 52 6.093 18.257 -4.078 1.00 0.00 H new ATOM 0 HD22 LEU B 52 6.499 19.620 -5.148 1.00 0.00 H new ATOM 0 HD23 LEU B 52 6.276 19.894 -3.404 1.00 0.00 H new ATOM 2017 N ARG B 53 3.757 24.127 -4.205 1.00 0.00 N ATOM 2018 CA ARG B 53 3.695 25.511 -4.652 1.00 0.00 C ATOM 2019 C ARG B 53 4.752 26.342 -3.917 1.00 0.00 C ATOM 2020 O ARG B 53 5.340 27.266 -4.483 1.00 0.00 O ATOM 2021 CB ARG B 53 2.283 26.058 -4.385 1.00 0.00 C ATOM 2022 CG ARG B 53 1.829 27.156 -5.335 1.00 0.00 C ATOM 2023 CD ARG B 53 2.578 28.454 -5.111 1.00 0.00 C ATOM 2024 NE ARG B 53 2.308 29.039 -3.802 1.00 0.00 N ATOM 2025 CZ ARG B 53 1.727 30.221 -3.620 1.00 0.00 C ATOM 2026 NH1 ARG B 53 1.291 30.927 -4.655 1.00 0.00 N ATOM 2027 NH2 ARG B 53 1.593 30.693 -2.394 1.00 0.00 N ATOM 0 H ARG B 53 2.870 23.765 -3.854 1.00 0.00 H new ATOM 0 HA ARG B 53 3.902 25.570 -5.721 1.00 0.00 H new ATOM 0 HB2 ARG B 53 1.573 25.233 -4.442 1.00 0.00 H new ATOM 0 HB3 ARG B 53 2.245 26.442 -3.365 1.00 0.00 H new ATOM 0 HG2 ARG B 53 1.975 26.827 -6.364 1.00 0.00 H new ATOM 0 HG3 ARG B 53 0.761 27.328 -5.204 1.00 0.00 H new ATOM 0 HD2 ARG B 53 3.648 28.273 -5.210 1.00 0.00 H new ATOM 0 HD3 ARG B 53 2.302 29.167 -5.888 1.00 0.00 H new ATOM 0 HE ARG B 53 2.582 28.508 -2.975 1.00 0.00 H new ATOM 0 HH11 ARG B 53 1.400 30.564 -5.602 1.00 0.00 H new ATOM 0 HH12 ARG B 53 0.847 31.833 -4.504 1.00 0.00 H new ATOM 0 HH21 ARG B 53 1.934 30.152 -1.599 1.00 0.00 H new ATOM 0 HH22 ARG B 53 1.149 31.599 -2.242 1.00 0.00 H new ATOM 2041 N GLU B 54 5.001 25.984 -2.661 1.00 0.00 N ATOM 2042 CA GLU B 54 5.983 26.687 -1.845 1.00 0.00 C ATOM 2043 C GLU B 54 7.394 26.121 -2.024 1.00 0.00 C ATOM 2044 O GLU B 54 8.368 26.873 -2.038 1.00 0.00 O ATOM 2045 CB GLU B 54 5.607 26.610 -0.363 1.00 0.00 C ATOM 2046 CG GLU B 54 4.205 27.103 -0.052 1.00 0.00 C ATOM 2047 CD GLU B 54 3.945 28.511 -0.547 1.00 0.00 C ATOM 2048 OE1 GLU B 54 4.835 29.375 -0.409 1.00 0.00 O ATOM 2049 OE2 GLU B 54 2.836 28.760 -1.066 1.00 0.00 O ATOM 0 H GLU B 54 4.535 25.210 -2.187 1.00 0.00 H new ATOM 0 HA GLU B 54 5.980 27.724 -2.180 1.00 0.00 H new ATOM 0 HB2 GLU B 54 5.699 25.577 -0.029 1.00 0.00 H new ATOM 0 HB3 GLU B 54 6.323 27.196 0.213 1.00 0.00 H new ATOM 0 HG2 GLU B 54 3.480 26.426 -0.504 1.00 0.00 H new ATOM 0 HG3 GLU B 54 4.045 27.068 1.026 1.00 0.00 H new ATOM 2056 N GLN B 55 7.522 24.804 -2.152 1.00 0.00 N ATOM 2057 CA GLN B 55 8.839 24.187 -2.151 1.00 0.00 C ATOM 2058 C GLN B 55 9.333 23.884 -3.563 1.00 0.00 C ATOM 2059 O GLN B 55 10.250 24.551 -4.047 1.00 0.00 O ATOM 2060 CB GLN B 55 8.813 22.903 -1.317 1.00 0.00 C ATOM 2061 CG GLN B 55 10.162 22.207 -1.198 1.00 0.00 C ATOM 2062 CD GLN B 55 11.178 23.006 -0.405 1.00 0.00 C ATOM 2063 OE1 GLN B 55 11.911 23.825 -0.959 1.00 0.00 O ATOM 2064 NE2 GLN B 55 11.235 22.766 0.895 1.00 0.00 N ATOM 0 H GLN B 55 6.742 24.154 -2.256 1.00 0.00 H new ATOM 0 HA GLN B 55 9.535 24.899 -1.708 1.00 0.00 H new ATOM 0 HB2 GLN B 55 8.450 23.140 -0.317 1.00 0.00 H new ATOM 0 HB3 GLN B 55 8.097 22.210 -1.760 1.00 0.00 H new ATOM 0 HG2 GLN B 55 10.022 21.236 -0.723 1.00 0.00 H new ATOM 0 HG3 GLN B 55 10.556 22.019 -2.197 1.00 0.00 H new ATOM 0 HE21 GLN B 55 10.609 22.079 1.315 1.00 0.00 H new ATOM 0 HE22 GLN B 55 11.905 23.268 1.477 1.00 0.00 H new ATOM 2073 N LEU B 56 8.682 22.925 -4.242 1.00 0.00 N ATOM 2074 CA LEU B 56 9.205 22.368 -5.500 1.00 0.00 C ATOM 2075 C LEU B 56 10.716 22.174 -5.392 1.00 0.00 C ATOM 2076 O LEU B 56 11.468 22.496 -6.316 1.00 0.00 O ATOM 2077 CB LEU B 56 8.879 23.283 -6.687 1.00 0.00 C ATOM 2078 CG LEU B 56 7.420 23.291 -7.139 1.00 0.00 C ATOM 2079 CD1 LEU B 56 7.217 24.285 -8.270 1.00 0.00 C ATOM 2080 CD2 LEU B 56 6.987 21.901 -7.571 1.00 0.00 C ATOM 0 H LEU B 56 7.795 22.520 -3.942 1.00 0.00 H new ATOM 0 HA LEU B 56 8.726 21.404 -5.672 1.00 0.00 H new ATOM 0 HB2 LEU B 56 9.164 24.302 -6.425 1.00 0.00 H new ATOM 0 HB3 LEU B 56 9.500 22.986 -7.532 1.00 0.00 H new ATOM 0 HG LEU B 56 6.802 23.598 -6.295 1.00 0.00 H new ATOM 0 HD11 LEU B 56 6.172 24.277 -8.579 1.00 0.00 H new ATOM 0 HD12 LEU B 56 7.487 25.284 -7.929 1.00 0.00 H new ATOM 0 HD13 LEU B 56 7.847 24.008 -9.115 1.00 0.00 H new ATOM 0 HD21 LEU B 56 5.945 21.927 -7.889 1.00 0.00 H new ATOM 0 HD22 LEU B 56 7.611 21.566 -8.399 1.00 0.00 H new ATOM 0 HD23 LEU B 56 7.094 21.210 -6.735 1.00 0.00 H new ATOM 2092 N GLY B 57 11.148 21.647 -4.255 1.00 0.00 N ATOM 2093 CA GLY B 57 12.558 21.660 -3.926 1.00 0.00 C ATOM 2094 C GLY B 57 13.241 20.321 -4.076 1.00 0.00 C ATOM 2095 O GLY B 57 14.475 20.265 -4.072 1.00 0.00 O ATOM 0 H GLY B 57 10.547 21.211 -3.555 1.00 0.00 H new ATOM 0 HA2 GLY B 57 13.062 22.386 -4.564 1.00 0.00 H new ATOM 0 HA3 GLY B 57 12.677 22.003 -2.898 1.00 0.00 H new ATOM 2099 N PHE B 58 12.460 19.246 -4.199 1.00 0.00 N ATOM 2100 CA PHE B 58 13.020 17.897 -4.313 1.00 0.00 C ATOM 2101 C PHE B 58 13.872 17.603 -3.079 1.00 0.00 C ATOM 2102 O PHE B 58 13.699 18.221 -2.024 1.00 0.00 O ATOM 2103 CB PHE B 58 13.912 17.766 -5.565 1.00 0.00 C ATOM 2104 CG PHE B 58 13.252 18.090 -6.879 1.00 0.00 C ATOM 2105 CD1 PHE B 58 12.867 19.386 -7.185 1.00 0.00 C ATOM 2106 CD2 PHE B 58 13.058 17.098 -7.824 1.00 0.00 C ATOM 2107 CE1 PHE B 58 12.296 19.683 -8.407 1.00 0.00 C ATOM 2108 CE2 PHE B 58 12.483 17.389 -9.044 1.00 0.00 C ATOM 2109 CZ PHE B 58 12.104 18.683 -9.336 1.00 0.00 C ATOM 0 H PHE B 58 11.441 19.282 -4.222 1.00 0.00 H new ATOM 0 HA PHE B 58 12.193 17.191 -4.394 1.00 0.00 H new ATOM 0 HB2 PHE B 58 14.775 18.421 -5.443 1.00 0.00 H new ATOM 0 HB3 PHE B 58 14.291 16.745 -5.613 1.00 0.00 H new ATOM 0 HD1 PHE B 58 13.015 20.172 -6.460 1.00 0.00 H new ATOM 0 HD2 PHE B 58 13.360 16.085 -7.604 1.00 0.00 H new ATOM 0 HE1 PHE B 58 12.001 20.697 -8.634 1.00 0.00 H new ATOM 0 HE2 PHE B 58 12.330 16.604 -9.770 1.00 0.00 H new ATOM 0 HZ PHE B 58 11.657 18.912 -10.292 1.00 0.00 H new ATOM 2119 N GLU B 59 14.782 16.653 -3.204 1.00 0.00 N ATOM 2120 CA GLU B 59 15.877 16.553 -2.258 1.00 0.00 C ATOM 2121 C GLU B 59 17.157 16.882 -3.004 1.00 0.00 C ATOM 2122 O GLU B 59 17.689 16.059 -3.753 1.00 0.00 O ATOM 2123 CB GLU B 59 15.952 15.165 -1.619 1.00 0.00 C ATOM 2124 CG GLU B 59 17.108 14.995 -0.642 1.00 0.00 C ATOM 2125 CD GLU B 59 17.061 15.974 0.515 1.00 0.00 C ATOM 2126 OE1 GLU B 59 17.468 17.139 0.328 1.00 0.00 O ATOM 2127 OE2 GLU B 59 16.651 15.576 1.626 1.00 0.00 O ATOM 0 H GLU B 59 14.785 15.949 -3.942 1.00 0.00 H new ATOM 0 HA GLU B 59 15.722 17.255 -1.438 1.00 0.00 H new ATOM 0 HB2 GLU B 59 15.016 14.965 -1.097 1.00 0.00 H new ATOM 0 HB3 GLU B 59 16.043 14.418 -2.407 1.00 0.00 H new ATOM 0 HG2 GLU B 59 17.097 13.978 -0.250 1.00 0.00 H new ATOM 0 HG3 GLU B 59 18.049 15.120 -1.177 1.00 0.00 H new ATOM 2134 N PHE B 60 17.636 18.094 -2.806 1.00 0.00 N ATOM 2135 CA PHE B 60 18.725 18.617 -3.604 1.00 0.00 C ATOM 2136 C PHE B 60 20.018 18.577 -2.813 1.00 0.00 C ATOM 2137 O PHE B 60 20.221 19.369 -1.893 1.00 0.00 O ATOM 2138 CB PHE B 60 18.411 20.052 -4.032 1.00 0.00 C ATOM 2139 CG PHE B 60 19.058 20.460 -5.324 1.00 0.00 C ATOM 2140 CD1 PHE B 60 20.375 20.885 -5.358 1.00 0.00 C ATOM 2141 CD2 PHE B 60 18.338 20.419 -6.508 1.00 0.00 C ATOM 2142 CE1 PHE B 60 20.966 21.259 -6.550 1.00 0.00 C ATOM 2143 CE2 PHE B 60 18.921 20.792 -7.702 1.00 0.00 C ATOM 2144 CZ PHE B 60 20.237 21.215 -7.724 1.00 0.00 C ATOM 0 H PHE B 60 17.286 18.737 -2.096 1.00 0.00 H new ATOM 0 HA PHE B 60 18.842 17.999 -4.494 1.00 0.00 H new ATOM 0 HB2 PHE B 60 17.331 20.164 -4.127 1.00 0.00 H new ATOM 0 HB3 PHE B 60 18.734 20.734 -3.245 1.00 0.00 H new ATOM 0 HD1 PHE B 60 20.947 20.925 -4.443 1.00 0.00 H new ATOM 0 HD2 PHE B 60 17.309 20.091 -6.496 1.00 0.00 H new ATOM 0 HE1 PHE B 60 21.995 21.585 -6.564 1.00 0.00 H new ATOM 0 HE2 PHE B 60 18.350 20.754 -8.618 1.00 0.00 H new ATOM 0 HZ PHE B 60 20.695 21.511 -8.656 1.00 0.00 H new ATOM 2154 N LYS B 61 20.889 17.649 -3.162 1.00 0.00 N ATOM 2155 CA LYS B 61 22.143 17.496 -2.452 1.00 0.00 C ATOM 2156 C LYS B 61 23.300 18.048 -3.270 1.00 0.00 C ATOM 2157 O LYS B 61 23.269 18.052 -4.500 1.00 0.00 O ATOM 2158 CB LYS B 61 22.401 16.025 -2.116 1.00 0.00 C ATOM 2159 CG LYS B 61 21.354 15.405 -1.202 1.00 0.00 C ATOM 2160 CD LYS B 61 21.260 16.144 0.122 1.00 0.00 C ATOM 2161 CE LYS B 61 20.335 15.431 1.092 1.00 0.00 C ATOM 2162 NZ LYS B 61 20.126 16.212 2.340 1.00 0.00 N ATOM 0 H LYS B 61 20.751 16.992 -3.930 1.00 0.00 H new ATOM 0 HA LYS B 61 22.069 18.062 -1.523 1.00 0.00 H new ATOM 0 HB2 LYS B 61 22.443 15.453 -3.043 1.00 0.00 H new ATOM 0 HB3 LYS B 61 23.379 15.937 -1.643 1.00 0.00 H new ATOM 0 HG2 LYS B 61 20.383 15.420 -1.697 1.00 0.00 H new ATOM 0 HG3 LYS B 61 21.603 14.360 -1.019 1.00 0.00 H new ATOM 0 HD2 LYS B 61 22.253 16.232 0.562 1.00 0.00 H new ATOM 0 HD3 LYS B 61 20.897 17.157 -0.050 1.00 0.00 H new ATOM 0 HE2 LYS B 61 19.373 15.253 0.611 1.00 0.00 H new ATOM 0 HE3 LYS B 61 20.753 14.456 1.341 1.00 0.00 H new ATOM 0 HZ1 LYS B 61 19.489 15.689 2.974 1.00 0.00 H new ATOM 0 HZ2 LYS B 61 21.040 16.361 2.814 1.00 0.00 H new ATOM 0 HZ3 LYS B 61 19.703 17.133 2.106 1.00 0.00 H new ATOM 2176 N ASN B 62 24.306 18.525 -2.568 1.00 0.00 N ATOM 2177 CA ASN B 62 25.526 19.005 -3.186 1.00 0.00 C ATOM 2178 C ASN B 62 26.696 18.494 -2.366 1.00 0.00 C ATOM 2179 O ASN B 62 26.617 18.461 -1.136 1.00 0.00 O ATOM 2180 CB ASN B 62 25.531 20.539 -3.237 1.00 0.00 C ATOM 2181 CG ASN B 62 26.710 21.100 -4.011 1.00 0.00 C ATOM 2182 OD1 ASN B 62 27.773 21.357 -3.448 1.00 0.00 O ATOM 2183 ND2 ASN B 62 26.528 21.311 -5.305 1.00 0.00 N ATOM 0 H ASN B 62 24.302 18.591 -1.550 1.00 0.00 H new ATOM 0 HA ASN B 62 25.600 18.641 -4.211 1.00 0.00 H new ATOM 0 HB2 ASN B 62 24.604 20.885 -3.695 1.00 0.00 H new ATOM 0 HB3 ASN B 62 25.550 20.931 -2.220 1.00 0.00 H new ATOM 0 HD21 ASN B 62 27.284 21.699 -5.870 1.00 0.00 H new ATOM 0 HD22 ASN B 62 25.632 21.085 -5.737 1.00 0.00 H new ATOM 2190 N ALA B 63 27.769 18.079 -3.024 1.00 0.00 N ATOM 2191 CA ALA B 63 28.897 17.485 -2.317 1.00 0.00 C ATOM 2192 C ALA B 63 29.661 18.536 -1.517 1.00 0.00 C ATOM 2193 O ALA B 63 30.496 18.202 -0.675 1.00 0.00 O ATOM 2194 CB ALA B 63 29.817 16.767 -3.289 1.00 0.00 C ATOM 0 H ALA B 63 27.883 18.141 -4.036 1.00 0.00 H new ATOM 0 HA ALA B 63 28.506 16.752 -1.611 1.00 0.00 H new ATOM 0 HB1 ALA B 63 30.653 16.330 -2.743 1.00 0.00 H new ATOM 0 HB2 ALA B 63 29.264 15.978 -3.798 1.00 0.00 H new ATOM 0 HB3 ALA B 63 30.195 17.477 -4.024 1.00 0.00 H new ATOM 2200 N GLN B 64 29.363 19.807 -1.789 1.00 0.00 N ATOM 2201 CA GLN B 64 29.937 20.931 -1.047 1.00 0.00 C ATOM 2202 C GLN B 64 31.454 20.965 -1.168 1.00 0.00 C ATOM 2203 O GLN B 64 32.147 21.511 -0.305 1.00 0.00 O ATOM 2204 CB GLN B 64 29.517 20.866 0.426 1.00 0.00 C ATOM 2205 CG GLN B 64 28.027 21.088 0.639 1.00 0.00 C ATOM 2206 CD GLN B 64 27.588 22.489 0.266 1.00 0.00 C ATOM 2207 OE1 GLN B 64 28.454 23.465 0.498 1.00 0.00 O flip ATOM 2208 NE2 GLN B 64 26.471 22.698 -0.203 1.00 0.00 N flip ATOM 0 H GLN B 64 28.718 20.086 -2.528 1.00 0.00 H new ATOM 0 HA GLN B 64 29.551 21.852 -1.485 1.00 0.00 H new ATOM 0 HB2 GLN B 64 29.794 19.893 0.833 1.00 0.00 H new ATOM 0 HB3 GLN B 64 30.073 21.616 0.988 1.00 0.00 H new ATOM 0 HG2 GLN B 64 27.467 20.366 0.045 1.00 0.00 H new ATOM 0 HG3 GLN B 64 27.781 20.900 1.684 1.00 0.00 H new ATOM 0 HE21 GLN B 64 25.833 21.919 -0.367 1.00 0.00 H new ATOM 0 HE22 GLN B 64 26.182 23.650 -0.428 1.00 0.00 H new ATOM 2217 N LEU B 65 31.964 20.406 -2.255 1.00 0.00 N ATOM 2218 CA LEU B 65 33.393 20.396 -2.504 1.00 0.00 C ATOM 2219 C LEU B 65 33.859 21.777 -2.950 1.00 0.00 C ATOM 2220 O LEU B 65 34.017 22.044 -4.142 1.00 0.00 O ATOM 2221 CB LEU B 65 33.752 19.336 -3.550 1.00 0.00 C ATOM 2222 CG LEU B 65 33.384 17.900 -3.172 1.00 0.00 C ATOM 2223 CD1 LEU B 65 33.755 16.939 -4.291 1.00 0.00 C ATOM 2224 CD2 LEU B 65 34.071 17.495 -1.875 1.00 0.00 C ATOM 0 H LEU B 65 31.406 19.953 -2.979 1.00 0.00 H new ATOM 0 HA LEU B 65 33.906 20.141 -1.577 1.00 0.00 H new ATOM 0 HB2 LEU B 65 33.253 19.588 -4.486 1.00 0.00 H new ATOM 0 HB3 LEU B 65 34.825 19.382 -3.738 1.00 0.00 H new ATOM 0 HG LEU B 65 32.306 17.853 -3.021 1.00 0.00 H new ATOM 0 HD11 LEU B 65 33.485 15.923 -4.003 1.00 0.00 H new ATOM 0 HD12 LEU B 65 33.218 17.213 -5.199 1.00 0.00 H new ATOM 0 HD13 LEU B 65 34.828 16.991 -4.475 1.00 0.00 H new ATOM 0 HD21 LEU B 65 33.797 16.471 -1.623 1.00 0.00 H new ATOM 0 HD22 LEU B 65 35.152 17.561 -2.000 1.00 0.00 H new ATOM 0 HD23 LEU B 65 33.757 18.163 -1.073 1.00 0.00 H new ATOM 2236 N GLU B 66 34.039 22.661 -1.978 1.00 0.00 N ATOM 2237 CA GLU B 66 34.493 24.020 -2.239 1.00 0.00 C ATOM 2238 C GLU B 66 35.974 24.036 -2.595 1.00 0.00 C ATOM 2239 O GLU B 66 36.461 24.998 -3.179 1.00 0.00 O ATOM 2240 CB GLU B 66 34.240 24.904 -1.012 1.00 0.00 C ATOM 2241 CG GLU B 66 34.938 24.416 0.249 1.00 0.00 C ATOM 2242 CD GLU B 66 34.718 25.325 1.441 1.00 0.00 C ATOM 2243 OE1 GLU B 66 35.349 26.394 1.503 1.00 0.00 O ATOM 2244 OE2 GLU B 66 33.932 24.962 2.337 1.00 0.00 O ATOM 0 H GLU B 66 33.876 22.458 -0.992 1.00 0.00 H new ATOM 0 HA GLU B 66 33.930 24.413 -3.086 1.00 0.00 H new ATOM 0 HB2 GLU B 66 34.573 25.918 -1.231 1.00 0.00 H new ATOM 0 HB3 GLU B 66 33.167 24.954 -0.826 1.00 0.00 H new ATOM 0 HG2 GLU B 66 34.579 23.416 0.492 1.00 0.00 H new ATOM 0 HG3 GLU B 66 36.008 24.333 0.056 1.00 0.00 H new ATOM 2251 N HIS B 67 36.672 22.956 -2.218 1.00 0.00 N ATOM 2252 CA HIS B 67 38.119 22.777 -2.442 1.00 0.00 C ATOM 2253 C HIS B 67 38.930 24.002 -1.985 1.00 0.00 C ATOM 2254 O HIS B 67 40.083 24.188 -2.372 1.00 0.00 O ATOM 2255 CB HIS B 67 38.426 22.379 -3.912 1.00 0.00 C ATOM 2256 CG HIS B 67 38.561 23.500 -4.908 1.00 0.00 C ATOM 2257 ND1 HIS B 67 39.783 23.989 -5.313 1.00 0.00 N ATOM 2258 CD2 HIS B 67 37.634 24.193 -5.613 1.00 0.00 C ATOM 2259 CE1 HIS B 67 39.602 24.933 -6.212 1.00 0.00 C ATOM 2260 NE2 HIS B 67 38.310 25.077 -6.412 1.00 0.00 N ATOM 0 H HIS B 67 36.241 22.165 -1.739 1.00 0.00 H new ATOM 0 HA HIS B 67 38.441 21.945 -1.816 1.00 0.00 H new ATOM 0 HB2 HIS B 67 39.352 21.804 -3.921 1.00 0.00 H new ATOM 0 HB3 HIS B 67 37.634 21.714 -4.256 1.00 0.00 H new ATOM 0 HD2 HIS B 67 36.562 24.071 -5.556 1.00 0.00 H new ATOM 0 HE1 HIS B 67 40.383 25.495 -6.703 1.00 0.00 H new ATOM 0 HE2 HIS B 67 37.881 25.740 -7.058 1.00 0.00 H new ATOM 2269 N HIS B 68 38.324 24.797 -1.112 1.00 0.00 N ATOM 2270 CA HIS B 68 38.953 25.991 -0.569 1.00 0.00 C ATOM 2271 C HIS B 68 39.840 25.601 0.608 1.00 0.00 C ATOM 2272 O HIS B 68 39.452 24.764 1.427 1.00 0.00 O ATOM 2273 CB HIS B 68 37.862 26.979 -0.130 1.00 0.00 C ATOM 2274 CG HIS B 68 38.356 28.328 0.294 1.00 0.00 C ATOM 2275 ND1 HIS B 68 38.217 28.811 1.577 1.00 0.00 N ATOM 2276 CD2 HIS B 68 38.952 29.316 -0.414 1.00 0.00 C ATOM 2277 CE1 HIS B 68 38.707 30.034 1.639 1.00 0.00 C ATOM 2278 NE2 HIS B 68 39.160 30.363 0.446 1.00 0.00 N ATOM 0 H HIS B 68 37.381 24.630 -0.761 1.00 0.00 H new ATOM 0 HA HIS B 68 39.573 26.470 -1.326 1.00 0.00 H new ATOM 0 HB2 HIS B 68 37.160 27.109 -0.953 1.00 0.00 H new ATOM 0 HB3 HIS B 68 37.306 26.537 0.697 1.00 0.00 H new ATOM 0 HD2 HIS B 68 39.215 29.285 -1.461 1.00 0.00 H new ATOM 0 HE1 HIS B 68 38.733 30.660 2.519 1.00 0.00 H new ATOM 0 HE2 HIS B 68 39.595 31.253 0.202 1.00 0.00 H new ATOM 2287 N HIS B 69 41.027 26.190 0.677 1.00 0.00 N ATOM 2288 CA HIS B 69 41.987 25.870 1.732 1.00 0.00 C ATOM 2289 C HIS B 69 41.378 26.157 3.102 1.00 0.00 C ATOM 2290 O HIS B 69 41.151 27.310 3.466 1.00 0.00 O ATOM 2291 CB HIS B 69 43.288 26.662 1.546 1.00 0.00 C ATOM 2292 CG HIS B 69 44.059 26.303 0.302 1.00 0.00 C ATOM 2293 ND1 HIS B 69 45.431 26.183 0.275 1.00 0.00 N ATOM 2294 CD2 HIS B 69 43.643 26.063 -0.965 1.00 0.00 C ATOM 2295 CE1 HIS B 69 45.824 25.889 -0.951 1.00 0.00 C ATOM 2296 NE2 HIS B 69 44.759 25.812 -1.723 1.00 0.00 N ATOM 0 H HIS B 69 41.351 26.894 0.014 1.00 0.00 H new ATOM 0 HA HIS B 69 42.226 24.808 1.669 1.00 0.00 H new ATOM 0 HB2 HIS B 69 43.052 27.726 1.519 1.00 0.00 H new ATOM 0 HB3 HIS B 69 43.926 26.500 2.415 1.00 0.00 H new ATOM 0 HD2 HIS B 69 42.621 26.068 -1.314 1.00 0.00 H new ATOM 0 HE1 HIS B 69 46.845 25.737 -1.267 1.00 0.00 H new ATOM 0 HE2 HIS B 69 44.763 25.600 -2.721 1.00 0.00 H new ATOM 2305 N HIS B 70 41.117 25.096 3.855 1.00 0.00 N ATOM 2306 CA HIS B 70 40.372 25.198 5.107 1.00 0.00 C ATOM 2307 C HIS B 70 41.288 25.312 6.324 1.00 0.00 C ATOM 2308 O HIS B 70 41.111 24.592 7.307 1.00 0.00 O ATOM 2309 CB HIS B 70 39.458 23.981 5.269 1.00 0.00 C ATOM 2310 CG HIS B 70 38.007 24.276 5.031 1.00 0.00 C ATOM 2311 ND1 HIS B 70 37.082 24.349 6.051 1.00 0.00 N ATOM 2312 CD2 HIS B 70 37.317 24.501 3.886 1.00 0.00 C ATOM 2313 CE1 HIS B 70 35.889 24.604 5.546 1.00 0.00 C ATOM 2314 NE2 HIS B 70 36.003 24.701 4.237 1.00 0.00 N ATOM 0 H HIS B 70 41.412 24.148 3.620 1.00 0.00 H new ATOM 0 HA HIS B 70 39.780 26.111 5.055 1.00 0.00 H new ATOM 0 HB2 HIS B 70 39.779 23.203 4.576 1.00 0.00 H new ATOM 0 HB3 HIS B 70 39.577 23.581 6.276 1.00 0.00 H new ATOM 0 HD2 HIS B 70 37.723 24.520 2.886 1.00 0.00 H new ATOM 0 HE1 HIS B 70 34.975 24.714 6.110 1.00 0.00 H new ATOM 0 HE2 HIS B 70 35.239 24.893 3.589 1.00 0.00 H new ATOM 2323 N HIS B 71 42.255 26.218 6.263 1.00 0.00 N ATOM 2324 CA HIS B 71 43.128 26.479 7.405 1.00 0.00 C ATOM 2325 C HIS B 71 43.858 27.798 7.224 1.00 0.00 C ATOM 2326 O HIS B 71 43.791 28.413 6.157 1.00 0.00 O ATOM 2327 CB HIS B 71 44.133 25.330 7.633 1.00 0.00 C ATOM 2328 CG HIS B 71 45.109 25.099 6.512 1.00 0.00 C ATOM 2329 ND1 HIS B 71 45.132 23.939 5.765 1.00 0.00 N ATOM 2330 CD2 HIS B 71 46.118 25.868 6.034 1.00 0.00 C ATOM 2331 CE1 HIS B 71 46.112 24.006 4.882 1.00 0.00 C ATOM 2332 NE2 HIS B 71 46.724 25.164 5.025 1.00 0.00 N ATOM 0 H HIS B 71 42.456 26.784 5.439 1.00 0.00 H new ATOM 0 HA HIS B 71 42.498 26.543 8.292 1.00 0.00 H new ATOM 0 HB2 HIS B 71 44.694 25.535 8.545 1.00 0.00 H new ATOM 0 HB3 HIS B 71 43.575 24.409 7.803 1.00 0.00 H new ATOM 0 HD2 HIS B 71 46.393 26.852 6.383 1.00 0.00 H new ATOM 0 HE1 HIS B 71 46.368 23.241 4.164 1.00 0.00 H new ATOM 0 HE2 HIS B 71 47.520 25.485 4.474 1.00 0.00 H new ATOM 2341 N HIS B 72 44.542 28.231 8.268 1.00 0.00 N ATOM 2342 CA HIS B 72 45.321 29.456 8.216 1.00 0.00 C ATOM 2343 C HIS B 72 46.712 29.174 7.660 1.00 0.00 C ATOM 2344 O HIS B 72 47.587 28.735 8.433 1.00 0.00 O ATOM 2345 CB HIS B 72 45.423 30.078 9.612 1.00 0.00 C ATOM 2346 CG HIS B 72 46.125 31.404 9.633 1.00 0.00 C ATOM 2347 ND1 HIS B 72 47.416 31.564 10.089 1.00 0.00 N ATOM 2348 CD2 HIS B 72 45.706 32.636 9.262 1.00 0.00 C ATOM 2349 CE1 HIS B 72 47.758 32.834 10.000 1.00 0.00 C ATOM 2350 NE2 HIS B 72 46.740 33.508 9.501 1.00 0.00 N ATOM 2351 OXT HIS B 72 46.923 29.393 6.452 1.00 0.00 O ATOM 0 H HIS B 72 44.574 27.750 9.167 1.00 0.00 H new ATOM 0 HA HIS B 72 44.818 30.162 7.555 1.00 0.00 H new ATOM 0 HB2 HIS B 72 44.419 30.202 10.019 1.00 0.00 H new ATOM 0 HB3 HIS B 72 45.951 29.387 10.270 1.00 0.00 H new ATOM 0 HD2 HIS B 72 44.738 32.887 8.854 1.00 0.00 H new ATOM 0 HE1 HIS B 72 48.711 33.252 10.287 1.00 0.00 H new ATOM 0 HE2 HIS B 72 46.723 34.512 9.322 1.00 0.00 H new TER 2360 HIS B 72